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Methoxybenzenes

Organic compounds that consist of a phenyl group with a methoxy functional group substitution; a methoxy group has an oxygen atom bonded to a methyl group.

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1

2-Methoxybenzonitrile, 99%

CAS: 6609-56-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001783 InChI Key: FSTPMFASNVISBU-UHFFFAOYSA-N Synonym: 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile PubChem CID: 81086 IUPAC Name: 2-methoxybenzonitrile SMILES: COC1=CC=CC=C1C#N

PubChem CID 81086
CAS 6609-56-9
Molecular Weight (g/mol) 133.15
MDL Number MFCD00001783
SMILES COC1=CC=CC=C1C#N
Synonym 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile
IUPAC Name 2-methoxybenzonitrile
InChI Key FSTPMFASNVISBU-UHFFFAOYSA-N
Molecular Formula C8H7NO
2

2-Methoxyphenylacetic acid, 99%

CAS: 93-25-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004321 InChI Key: IVEWTCACRDEAOB-UHFFFAOYSA-N Synonym: 2-methoxyphenylacetic acid,benzeneacetic acid, 2-methoxy,2-2-methoxyphenyl acetic acid,2-methoxyphenylaceticacid,o-methoxyphenyl acetic acid,acetic acid, o-methoxyphenyl,2-methoxyphenyl acetic acid,o-methoxyphenylacetic acid,acmc-209rku,2-carboxymethyl anisole PubChem CID: 7134 IUPAC Name: 2-(2-methoxyphenyl)acetic acid SMILES: COC1=CC=CC=C1CC(O)=O

PubChem CID 7134
CAS 93-25-4
Molecular Weight (g/mol) 166.18
MDL Number MFCD00004321
SMILES COC1=CC=CC=C1CC(O)=O
Synonym 2-methoxyphenylacetic acid,benzeneacetic acid, 2-methoxy,2-2-methoxyphenyl acetic acid,2-methoxyphenylaceticacid,o-methoxyphenyl acetic acid,acetic acid, o-methoxyphenyl,2-methoxyphenyl acetic acid,o-methoxyphenylacetic acid,acmc-209rku,2-carboxymethyl anisole
IUPAC Name 2-(2-methoxyphenyl)acetic acid
InChI Key IVEWTCACRDEAOB-UHFFFAOYSA-N
Molecular Formula C9H10O3
3

2-Bromo-4-chloroanisole, 98%, Thermo Scientific™

CAS: 60633-25-2 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.48 MDL Number: MFCD00079705 InChI Key: YJEMGEBDXDPBSP-UHFFFAOYSA-N Synonym: 2-bromo-4-chloroanisole,2-bromo-4-chloro-1-methoxy-benzene,benzene, 2-bromo-4-chloro-1-methoxy,4-chloro-2-bromoanisole,pubchem2629,2-bromo4-chloroanisole,4-chloro-2-bromanisole,2-bromo-4-chloro anisole,acmc-1b9j6,ksc490k3r PubChem CID: 521935 IUPAC Name: 2-bromo-4-chloro-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Cl)Br

PubChem CID 521935
CAS 60633-25-2
Molecular Weight (g/mol) 221.48
MDL Number MFCD00079705
SMILES COC1=C(C=C(C=C1)Cl)Br
Synonym 2-bromo-4-chloroanisole,2-bromo-4-chloro-1-methoxy-benzene,benzene, 2-bromo-4-chloro-1-methoxy,4-chloro-2-bromoanisole,pubchem2629,2-bromo4-chloroanisole,4-chloro-2-bromanisole,2-bromo-4-chloro anisole,acmc-1b9j6,ksc490k3r
IUPAC Name 2-bromo-4-chloro-1-methoxybenzene
InChI Key YJEMGEBDXDPBSP-UHFFFAOYSA-N
Molecular Formula C7H6BrClO
4

4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 97%

CAS: 122-48-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00048232 InChI Key: OJYLAHXKWMRDGS-UHFFFAOYSA-N Synonym: zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl PubChem CID: 31211 ChEBI: CHEBI:68657 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC(=C(C=C1)O)OC

PubChem CID 31211
CAS 122-48-5
Molecular Weight (g/mol) 194.23
ChEBI CHEBI:68657
MDL Number MFCD00048232
SMILES CC(=O)CCC1=CC(=C(C=C1)O)OC
Synonym zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl
IUPAC Name 4-(4-hydroxy-3-methoxyphenyl)butan-2-one
InChI Key OJYLAHXKWMRDGS-UHFFFAOYSA-N
Molecular Formula C11H14O3
5

4-Chloroanisole, 99%

CAS: 623-12-1 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.58 InChI Key: YRGAYAGBVIXNAQ-UHFFFAOYSA-N Synonym: 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q PubChem CID: 12167 IUPAC Name: 1-chloro-4-methoxybenzene SMILES: COC1=CC=C(C=C1)Cl

PubChem CID 12167
CAS 623-12-1
Molecular Weight (g/mol) 142.58
SMILES COC1=CC=C(C=C1)Cl
Synonym 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q
IUPAC Name 1-chloro-4-methoxybenzene
InChI Key YRGAYAGBVIXNAQ-UHFFFAOYSA-N
Molecular Formula C7H7ClO
6

3,4,5-Trimethoxyphenylacetic acid, 99%

CAS: 951-82-6 Molecular Formula: C11H14O5 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00004336 InChI Key: DDSJXCGGOXKGSJ-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxyphenylacetic acid,2-3,4,5-trimethoxyphenyl acetic acid,3,4,5-trimethoxyphenyl acetic acid,benzeneacetic acid, 3,4,5-trimethoxy,3,4,5-trimethoxyphenylaceticacid,pubchem14015,acmc-209rv8,ksc487g4j,3,4,5-trimethoxybenzeneacetic acid,benzeneacetic acid,4,5-trimethoxy PubChem CID: 70372 IUPAC Name: 2-(3,4,5-trimethoxyphenyl)acetic acid SMILES: COC1=CC(=CC(=C1OC)OC)CC(=O)O

PubChem CID 70372
CAS 951-82-6
Molecular Weight (g/mol) 226.23
MDL Number MFCD00004336
SMILES COC1=CC(=CC(=C1OC)OC)CC(=O)O
Synonym 3,4,5-trimethoxyphenylacetic acid,2-3,4,5-trimethoxyphenyl acetic acid,3,4,5-trimethoxyphenyl acetic acid,benzeneacetic acid, 3,4,5-trimethoxy,3,4,5-trimethoxyphenylaceticacid,pubchem14015,acmc-209rv8,ksc487g4j,3,4,5-trimethoxybenzeneacetic acid,benzeneacetic acid,4,5-trimethoxy
IUPAC Name 2-(3,4,5-trimethoxyphenyl)acetic acid
InChI Key DDSJXCGGOXKGSJ-UHFFFAOYSA-N
Molecular Formula C11H14O5
7

Homovanillic acid, 98%

CAS: 306-08-1 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00004350 InChI Key: QRMZSPFSDQBLIX-UHFFFAOYSA-N Synonym: homovanillic acid,4-hydroxy-3-methoxyphenylacetic acid,2-4-hydroxy-3-methoxyphenyl acetic acid,vanillacetic acid,benzeneacetic acid, 4-hydroxy-3-methoxy,3-methoxy-4-hydroxyphenylacetic acid,homovaniuic acid,4-hydroxy-3-methoxyphenyl acetic acid,homovanillate,4-hydroxy-3-methoxybenzeneacetic acid PubChem CID: 1738 ChEBI: CHEBI:545959 IUPAC Name: 2-(4-hydroxy-3-methoxyphenyl)acetic acid SMILES: COC1=C(C=CC(=C1)CC(=O)O)O

PubChem CID 1738
CAS 306-08-1
Molecular Weight (g/mol) 182.175
ChEBI CHEBI:545959
MDL Number MFCD00004350
SMILES COC1=C(C=CC(=C1)CC(=O)O)O
Synonym homovanillic acid,4-hydroxy-3-methoxyphenylacetic acid,2-4-hydroxy-3-methoxyphenyl acetic acid,vanillacetic acid,benzeneacetic acid, 4-hydroxy-3-methoxy,3-methoxy-4-hydroxyphenylacetic acid,homovaniuic acid,4-hydroxy-3-methoxyphenyl acetic acid,homovanillate,4-hydroxy-3-methoxybenzeneacetic acid
IUPAC Name 2-(4-hydroxy-3-methoxyphenyl)acetic acid
InChI Key QRMZSPFSDQBLIX-UHFFFAOYSA-N
Molecular Formula C9H10O4
8

3-Methoxyphenethyl alcohol, 97%

CAS: 5020-41-7 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002893 InChI Key: UPPGEJSCUZMCMW-UHFFFAOYSA-N Synonym: 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol PubChem CID: 78724 IUPAC Name: 2-(3-methoxyphenyl)ethanol SMILES: COC1=CC=CC(=C1)CCO

PubChem CID 78724
CAS 5020-41-7
Molecular Weight (g/mol) 152.19
MDL Number MFCD00002893
SMILES COC1=CC=CC(=C1)CCO
Synonym 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol
IUPAC Name 2-(3-methoxyphenyl)ethanol
InChI Key UPPGEJSCUZMCMW-UHFFFAOYSA-N
Molecular Formula C9H12O2
9

o-Anisic acid, 99%

CAS: 579-75-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002431 InChI Key: ILUJQPXNXACGAN-UHFFFAOYSA-N Synonym: o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid PubChem CID: 11370 ChEBI: CHEBI:421840 IUPAC Name: 2-methoxybenzoic acid SMILES: COC1=CC=CC=C1C(=O)O

PubChem CID 11370
CAS 579-75-9
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:421840
MDL Number MFCD00002431
SMILES COC1=CC=CC=C1C(=O)O
Synonym o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid
IUPAC Name 2-methoxybenzoic acid
InChI Key ILUJQPXNXACGAN-UHFFFAOYSA-N
Molecular Formula C8H8O3
10

2-Methoxy-5-methylbenzonitrile, 97%, Thermo Scientific™

CAS: 53078-70-9 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 InChI Key: MYOASWSDRGHGLN-UHFFFAOYSA-N Synonym: 2-methoxy-5-methyl-benzonitrile,acmc-1an2t,benzonitrile,2-methoxy-5-methyl,2-methoxy-5-methylbenzonitrile PubChem CID: 3801023 IUPAC Name: 2-methoxy-5-methylbenzonitrile SMILES: CC1=CC(=C(C=C1)OC)C#N

PubChem CID 3801023
CAS 53078-70-9
Molecular Weight (g/mol) 147.18
SMILES CC1=CC(=C(C=C1)OC)C#N
Synonym 2-methoxy-5-methyl-benzonitrile,acmc-1an2t,benzonitrile,2-methoxy-5-methyl,2-methoxy-5-methylbenzonitrile
IUPAC Name 2-methoxy-5-methylbenzonitrile
InChI Key MYOASWSDRGHGLN-UHFFFAOYSA-N
Molecular Formula C9H9NO
11

2,6-Difluoroanisole, 98%, Thermo Scientific™

CAS: 437-82-1 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.12 InChI Key: IOBWAHRFIPQEQL-UHFFFAOYSA-N Synonym: 2,6-difluoroanisole,1,3-difluoro-2-methoxy-benzene,benzene, 1,3-difluoro-2-methoxy,pubchem1968,2,6-difluoro anisole,2.6-difluoro anisole,acmc-1ajjj,ksc235o3h,iobwahrfipqeql-uhfffaoysa PubChem CID: 2736897 IUPAC Name: 1,3-difluoro-2-methoxybenzene SMILES: COC1=C(C=CC=C1F)F

PubChem CID 2736897
CAS 437-82-1
Molecular Weight (g/mol) 144.12
SMILES COC1=C(C=CC=C1F)F
Synonym 2,6-difluoroanisole,1,3-difluoro-2-methoxy-benzene,benzene, 1,3-difluoro-2-methoxy,pubchem1968,2,6-difluoro anisole,2.6-difluoro anisole,acmc-1ajjj,ksc235o3h,iobwahrfipqeql-uhfffaoysa
IUPAC Name 1,3-difluoro-2-methoxybenzene
InChI Key IOBWAHRFIPQEQL-UHFFFAOYSA-N
Molecular Formula C7H6F2O
12

3-Bromo-4-methoxybenzonitrile, 99%, Thermo Scientific™

CAS: 117572-79-9 Molecular Formula: C8H6BrNO Molecular Weight (g/mol): 212.05 MDL Number: MFCD00143097 InChI Key: QHWZMDRKTYTPEE-UHFFFAOYSA-N Synonym: 2-bromo-4-cyanoanisole,3-bromo-4-methoxylbenzonitrile,3-bromo-4-methoxybenzenecarbonitrile,3-bromo-4-methoxy-benzonitrile,benzonitrile, 3-bromo-4-methoxy,pubchem3795,acmc-1cexj,maybridge4_001971,3-bromo4-methoxybenzonitrile,ksc494m8l PubChem CID: 736049 IUPAC Name: 3-bromo-4-methoxybenzonitrile SMILES: COC1=CC=C(C=C1Br)C#N

PubChem CID 736049
CAS 117572-79-9
Molecular Weight (g/mol) 212.05
MDL Number MFCD00143097
SMILES COC1=CC=C(C=C1Br)C#N
Synonym 2-bromo-4-cyanoanisole,3-bromo-4-methoxylbenzonitrile,3-bromo-4-methoxybenzenecarbonitrile,3-bromo-4-methoxy-benzonitrile,benzonitrile, 3-bromo-4-methoxy,pubchem3795,acmc-1cexj,maybridge4_001971,3-bromo4-methoxybenzonitrile,ksc494m8l
IUPAC Name 3-bromo-4-methoxybenzonitrile
InChI Key QHWZMDRKTYTPEE-UHFFFAOYSA-N
Molecular Formula C8H6BrNO
13

Alfa Aesar™ 3-(4-Methoxyphenyl)-1H-pyrazole, 98%

CAS: 27069-17-6 Molecular Formula: C10H10N2O Molecular Weight (g/mol): 174.20 MDL Number: MFCD00112008 InChI Key: QUSABYOAMXPMQH-UHFFFAOYSA-N Synonym: 3-4-methoxyphenyl-1h-pyrazole,3-4-methoxyphenyl pyrazole,5-4-methoxyphenyl-1h-pyrazole,chembl39210,3-4-methoxy-phenyl-1h-pyrazole,1h-pyrazole, 3-4-methoxyphenyl,4-methoxy-1-pyrazol-3-ylbenzene,3-4-methoxyphenyl-2h-pyrazole,maybridge1_007801,3-4-methoxyphenyl-pyrazole PubChem CID: 599984 IUPAC Name: 5-(4-methoxyphenyl)-1H-pyrazole SMILES: COC1=CC=C(C=C1)C1=CC=NN1

PubChem CID 599984
CAS 27069-17-6
Molecular Weight (g/mol) 174.20
MDL Number MFCD00112008
SMILES COC1=CC=C(C=C1)C1=CC=NN1
Synonym 3-4-methoxyphenyl-1h-pyrazole,3-4-methoxyphenyl pyrazole,5-4-methoxyphenyl-1h-pyrazole,chembl39210,3-4-methoxy-phenyl-1h-pyrazole,1h-pyrazole, 3-4-methoxyphenyl,4-methoxy-1-pyrazol-3-ylbenzene,3-4-methoxyphenyl-2h-pyrazole,maybridge1_007801,3-4-methoxyphenyl-pyrazole
IUPAC Name 5-(4-methoxyphenyl)-1H-pyrazole
InChI Key QUSABYOAMXPMQH-UHFFFAOYSA-N
Molecular Formula C10H10N2O