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Aromatic hydrocarbons

Organic compounds made up entirely of hydrogen and carbon elements usually organized in a chain, and have an aromatic (aryl) functional group.

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1

2-Methylindene, Thermo Scientific Chemicals

CAS: 2177-47-1 Molecular Formula: C10H10 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00274253 InChI Key: YSAXEHWHSLANOM-UHFFFAOYSA-N IUPAC Name: 2-methyl-1H-indene SMILES: CC1=CC2=CC=CC=C2C1

CAS 2177-47-1
Molecular Weight (g/mol) 130.19
MDL Number MFCD00274253
SMILES CC1=CC2=CC=CC=C2C1
IUPAC Name 2-methyl-1H-indene
InChI Key YSAXEHWHSLANOM-UHFFFAOYSA-N
Molecular Formula C10H10
2

2-Phenylindene, Thermo Scientific Chemicals

CAS: 4505-48-0 Molecular Formula: C15H12 Molecular Weight (g/mol): 192.26 MDL Number: MFCD00239514 InChI Key: BSBXLZYWGGAVHD-UHFFFAOYSA-N IUPAC Name: 2-phenyl-1H-indene SMILES: C1C2=CC=CC=C2C=C1C1=CC=CC=C1

CAS 4505-48-0
Molecular Weight (g/mol) 192.26
MDL Number MFCD00239514
SMILES C1C2=CC=CC=C2C=C1C1=CC=CC=C1
IUPAC Name 2-phenyl-1H-indene
InChI Key BSBXLZYWGGAVHD-UHFFFAOYSA-N
Molecular Formula C15H12
3

Bis(pentamethylcyclopentadienyl)zirconium dichloride, 99%, Thermo Scientific Chemicals

CAS: 54039-38-2 Molecular Formula: C20H30Cl2Zr-2 Molecular Weight (g/mol): 432.584 MDL Number: MFCD00058849 InChI Key: OCFSLQKTBFSWPL-UHFFFAOYSA-L Synonym: decamethylzirconocene dichloride PubChem CID: 57369741 IUPAC Name: dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl

PubChem CID 57369741
CAS 54039-38-2
Molecular Weight (g/mol) 432.584
MDL Number MFCD00058849
SMILES C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl
Synonym decamethylzirconocene dichloride
IUPAC Name dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene
InChI Key OCFSLQKTBFSWPL-UHFFFAOYSA-L
Molecular Formula C20H30Cl2Zr-2
4

Bibenzyl, 99%

CAS: 103-29-7 Molecular Formula: C14H14 Molecular Weight (g/mol): 182.27 MDL Number: MFCD00004796 InChI Key: QWUWMCYKGHVNAV-UHFFFAOYSA-N Synonym: 1,2-diphenylethane,bibenzyl,dibenzyl,s-diphenylethane,2-phenylethyl benzene,1,2-dihydrostilbene,dibenzil,sym-diphenylethane,dihydrostilbene,benzene, 1,1'-1,2-ethanediyl bis PubChem CID: 7647 ChEBI: CHEBI:34047 IUPAC Name: 2-phenylethylbenzene SMILES: C(CC1=CC=CC=C1)C1=CC=CC=C1

EDGE
PubChem CID 7647
CAS 103-29-7
Molecular Weight (g/mol) 182.27
ChEBI CHEBI:34047
MDL Number MFCD00004796
SMILES C(CC1=CC=CC=C1)C1=CC=CC=C1
Synonym 1,2-diphenylethane,bibenzyl,dibenzyl,s-diphenylethane,2-phenylethyl benzene,1,2-dihydrostilbene,dibenzil,sym-diphenylethane,dihydrostilbene,benzene, 1,1'-1,2-ethanediyl bis
IUPAC Name 2-phenylethylbenzene
InChI Key QWUWMCYKGHVNAV-UHFFFAOYSA-N
Molecular Formula C14H14
5

Ethylbenzene, 99.8%, pure

CAS: 100-41-4 MDL Number: MFCD00011647 InChI Key: YNQLUTRBYVCPMQ-UHFFFAOYSA-N Synonym: phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene PubChem CID: 7500 ChEBI: CHEBI:16101 IUPAC Name: ethylbenzene SMILES: CCC1=CC=CC=C1

PubChem CID 7500
CAS 100-41-4
ChEBI CHEBI:16101
MDL Number MFCD00011647
SMILES CCC1=CC=CC=C1
Synonym phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene
IUPAC Name ethylbenzene
InChI Key YNQLUTRBYVCPMQ-UHFFFAOYSA-N
6

Ethylbenzene, 99.8%, anhydrous, AcroSeal™

CAS: 100-41-4 Molecular Formula: C8H10 Molecular Weight (g/mol): 106.17 InChI Key: YNQLUTRBYVCPMQ-UHFFFAOYSA-N Synonym: phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene PubChem CID: 7500 ChEBI: CHEBI:16101 IUPAC Name: ethylbenzene SMILES: CCC1=CC=CC=C1

PubChem CID 7500
CAS 100-41-4
Molecular Weight (g/mol) 106.17
ChEBI CHEBI:16101
SMILES CCC1=CC=CC=C1
Synonym phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene
IUPAC Name ethylbenzene
InChI Key YNQLUTRBYVCPMQ-UHFFFAOYSA-N
Molecular Formula C8H10
7

Hexamethylbenzene, 98+%

CAS: 87-85-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.27 MDL Number: MFCD00008523 InChI Key: YUWFEBAXEOLKSG-UHFFFAOYSA-N Synonym: hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene; PubChem CID: 6908 ChEBI: CHEBI:39001 IUPAC Name: 1,2,3,4,5,6-hexamethylbenzene SMILES: CC1=C(C(=C(C(=C1C)C)C)C)C

PubChem CID 6908
CAS 87-85-4
Molecular Weight (g/mol) 162.27
ChEBI CHEBI:39001
MDL Number MFCD00008523
SMILES CC1=C(C(=C(C(=C1C)C)C)C)C
Synonym hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene;
IUPAC Name 1,2,3,4,5,6-hexamethylbenzene
InChI Key YUWFEBAXEOLKSG-UHFFFAOYSA-N
Molecular Formula C12H18
8

n-Butylbenzene, 99+%

CAS: 104-51-8 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00009463 InChI Key: OCKPCBLVNKHBMX-UHFFFAOYSA-N Synonym: n-butylbenzene,1-phenylbutane,benzene, butyl,1-butylbenzene,butyl-benzene,butane, phenyl,unii-s8xz2901rz,butylbenzene, analytical standard,n-butyl benzene,n4b PubChem CID: 7705 ChEBI: CHEBI:44194 IUPAC Name: butylbenzene SMILES: CCCCC1=CC=CC=C1

PubChem CID 7705
CAS 104-51-8
Molecular Weight (g/mol) 134.22
ChEBI CHEBI:44194
MDL Number MFCD00009463
SMILES CCCCC1=CC=CC=C1
Synonym n-butylbenzene,1-phenylbutane,benzene, butyl,1-butylbenzene,butyl-benzene,butane, phenyl,unii-s8xz2901rz,butylbenzene, analytical standard,n-butyl benzene,n4b
IUPAC Name butylbenzene
InChI Key OCKPCBLVNKHBMX-UHFFFAOYSA-N
Molecular Formula C10H14
9

Mesitylene, 99%, Extra Pure

CAS: 108-67-8 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.19 MDL Number: MFCD00008538 InChI Key: AUHZEENZYGFFBQ-UHFFFAOYSA-N Synonym: mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene PubChem CID: 7947 ChEBI: CHEBI:34833 IUPAC Name: 1,3,5-trimethylbenzene SMILES: CC1=CC(=CC(=C1)C)C

PubChem CID 7947
CAS 108-67-8
Molecular Weight (g/mol) 120.19
ChEBI CHEBI:34833
MDL Number MFCD00008538
SMILES CC1=CC(=CC(=C1)C)C
Synonym mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene
IUPAC Name 1,3,5-trimethylbenzene
InChI Key AUHZEENZYGFFBQ-UHFFFAOYSA-N
Molecular Formula C9H12
10

Mesitylene, 97%, pure

CAS: 108-67-8 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.19 MDL Number: MFCD00008538 InChI Key: AUHZEENZYGFFBQ-UHFFFAOYSA-N Synonym: mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene PubChem CID: 7947 ChEBI: CHEBI:34833 IUPAC Name: 1,3,5-trimethylbenzene SMILES: CC1=CC(=CC(=C1)C)C

PubChem CID 7947
CAS 108-67-8
Molecular Weight (g/mol) 120.19
ChEBI CHEBI:34833
MDL Number MFCD00008538
SMILES CC1=CC(=CC(=C1)C)C
Synonym mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene
IUPAC Name 1,3,5-trimethylbenzene
InChI Key AUHZEENZYGFFBQ-UHFFFAOYSA-N
Molecular Formula C9H12
11

(Pentamethylcyclopentadienyl)iridium(III) Chloride dimer, 99%

CAS: 12354-84-6 Molecular Formula: C20H30Cl4Ir2 Molecular Weight (g/mol): 796.73 MDL Number: MFCD00075435 InChI Key: MMAGMBCAIFVRGJ-UHFFFAOYSA-J Synonym: unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di PubChem CID: 76030743 IUPAC Name: iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]

PubChem CID 76030743
CAS 12354-84-6
Molecular Weight (g/mol) 796.73
MDL Number MFCD00075435
SMILES C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]
Synonym unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di
IUPAC Name iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride
InChI Key MMAGMBCAIFVRGJ-UHFFFAOYSA-J
Molecular Formula C20H30Cl4Ir2
12

1-Phenyldodecane, 97%

CAS: 123-01-3 Molecular Formula: C18H30 Molecular Weight (g/mol): 246.43 MDL Number: MFCD00008974 InChI Key: KWKXNDCHNDYVRT-UHFFFAOYSA-N Synonym: 1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan PubChem CID: 31237 IUPAC Name: dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=CC=C1

PubChem CID 31237
CAS 123-01-3
Molecular Weight (g/mol) 246.43
MDL Number MFCD00008974
SMILES CCCCCCCCCCCCC1=CC=CC=C1
Synonym 1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan
IUPAC Name dodecylbenzene
InChI Key KWKXNDCHNDYVRT-UHFFFAOYSA-N
Molecular Formula C18H30
13

3-Phenyltoluene, 95%

CAS: 643-93-6 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00008533 InChI Key: NPDIDUXTRAITDE-UHFFFAOYSA-N Synonym: 3-methylbiphenyl,3-phenyltoluene,3-methyl-1,1'biphenyl,1,1'-biphenyl, 3-methyl,3-methyl-1,1'-biphenyl,biphenyl, 3-methyl,unii-kfp6eo4j6p,kfp6eo4j6p,1-methyl-3-phenyl-benzene,3-methyl-biphenyl PubChem CID: 12564 IUPAC Name: 1-methyl-3-phenylbenzene SMILES: CC1=CC=CC(=C1)C2=CC=CC=C2

PubChem CID 12564
CAS 643-93-6
Molecular Weight (g/mol) 168.24
MDL Number MFCD00008533
SMILES CC1=CC=CC(=C1)C2=CC=CC=C2
Synonym 3-methylbiphenyl,3-phenyltoluene,3-methyl-1,1'biphenyl,1,1'-biphenyl, 3-methyl,3-methyl-1,1'-biphenyl,biphenyl, 3-methyl,unii-kfp6eo4j6p,kfp6eo4j6p,1-methyl-3-phenyl-benzene,3-methyl-biphenyl
IUPAC Name 1-methyl-3-phenylbenzene
InChI Key NPDIDUXTRAITDE-UHFFFAOYSA-N
Molecular Formula C13H12
14

Octadecylbenzene, 98%

CAS: 4445-07-2 Molecular Formula: C24H42 Molecular Weight (g/mol): 330.59 MDL Number: MFCD00048500 InChI Key: WSVDSBZMYJJMSB-UHFFFAOYSA-N IUPAC Name: octadecylbenzene SMILES: CCCCCCCCCCCCCCCCCCC1=CC=CC=C1

CAS 4445-07-2
Molecular Weight (g/mol) 330.59
MDL Number MFCD00048500
SMILES CCCCCCCCCCCCCCCCCCC1=CC=CC=C1
IUPAC Name octadecylbenzene
InChI Key WSVDSBZMYJJMSB-UHFFFAOYSA-N
Molecular Formula C24H42
15

1-Phenyloctane, 99%

CAS: 2189-60-8 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00009564 InChI Key: CDKDZKXSXLNROY-UHFFFAOYSA-N Synonym: n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg PubChem CID: 16607 IUPAC Name: octylbenzene SMILES: CCCCCCCCC1=CC=CC=C1

PubChem CID 16607
CAS 2189-60-8
Molecular Weight (g/mol) 190.33
MDL Number MFCD00009564
SMILES CCCCCCCCC1=CC=CC=C1
Synonym n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg
IUPAC Name octylbenzene
InChI Key CDKDZKXSXLNROY-UHFFFAOYSA-N
Molecular Formula C14H22