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Indanes

Bicyclic organic compounds that consist of a benzene ring fused to a cyclopentene group; cyclopentene is a five-carbon ring.

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1

Indane, 95%

CAS: 496-11-7 MDL Number: MFCD00003795 InChI Key: PQNFLJBBNBOBRQ-UHFFFAOYSA-N Synonym: indan,indane,hydrindene,benzocyclopentane,1h-indene, 2,3-dihydro,2,3-dihydroindene,1,2-hydrindene,hydrindonaphthene,indane alkane,indene, 2,3-dihydro PubChem CID: 10326 ChEBI: CHEBI:37911 IUPAC Name: 2,3-dihydro-1H-indene SMILES: C1CC2=CC=CC=C2C1

PubChem CID 10326
CAS 496-11-7
ChEBI CHEBI:37911
MDL Number MFCD00003795
SMILES C1CC2=CC=CC=C2C1
Synonym indan,indane,hydrindene,benzocyclopentane,1h-indene, 2,3-dihydro,2,3-dihydroindene,1,2-hydrindene,hydrindonaphthene,indane alkane,indene, 2,3-dihydro
IUPAC Name 2,3-dihydro-1H-indene
InChI Key PQNFLJBBNBOBRQ-UHFFFAOYSA-N
2

2,3-Dihydro-5,6-dimethoxy-2-[(1-oxido-4-pyridinyl)methylene]-1H-inden-1-one, TRC

CAS: 896134-06-8 Molecular Formula: C17 H15 N O4 Molecular Weight (g/mol): 297.3 Synonym: 2,3-Dihydro-5,6-dimethoxy-2-[(1-oxido-4-pyridinyl)methylene]-1H-inden-1-one; IUPAC Name: 5,6-dimethoxy-2-[(1-oxidopyridin-1-ium-4-yl)methylene]indan-1-one SMILES: COc1cc2CC(=Cc3cc[n+]([O-])cc3)C(=O)c2cc1OC

CAS 896134-06-8
Molecular Weight (g/mol) 297.3
SMILES COc1cc2CC(=Cc3cc[n+]([O-])cc3)C(=O)c2cc1OC
Synonym 2,3-Dihydro-5,6-dimethoxy-2-[(1-oxido-4-pyridinyl)methylene]-1H-inden-1-one;
IUPAC Name 5,6-dimethoxy-2-[(1-oxidopyridin-1-ium-4-yl)methylene]indan-1-one
Molecular Formula C17 H15 N O4
3

Desbenzyl Donepezil Hydrochloride, TRC

CAS: 120013-39-0 Molecular Formula: C17 H23 N O3 . Cl H Molecular Weight (g/mol): 325.83 Synonym: 2,3-Dihydro-5,6-dimethoxy-2-[(4-piperidinyl)methyl]indan-1-one Hydrochloride IUPAC Name: 5,6-dimethoxy-2-(piperidin-4-ylmethyl)-2,3-dihydroinden-1-one;hydrochloride SMILES: Cl.COc1cc2CC(CC3CCNCC3)C(=O)c2cc1OC

CAS 120013-39-0
Molecular Weight (g/mol) 325.83
SMILES Cl.COc1cc2CC(CC3CCNCC3)C(=O)c2cc1OC
Synonym 2,3-Dihydro-5,6-dimethoxy-2-[(4-piperidinyl)methyl]indan-1-one Hydrochloride
IUPAC Name 5,6-dimethoxy-2-(piperidin-4-ylmethyl)-2,3-dihydroinden-1-one;hydrochloride
Molecular Formula C17 H23 N O3 . Cl H
5

2-[2-(Dimethylamino)ethyl]-1-indanone (>90%), TRC

CAS: 3409-21-0 Molecular Formula: C13 H17 N O Molecular Weight (g/mol): 203.2802 Synonym: 2-[2-(Dimethylamino)ethyl]-2,3-dihydro-1H-inden-1-one IUPAC Name: 2-[2-(dimethylamino)ethyl]-2,3-dihydroinden-1-one SMILES: CN(C)CCC1Cc2ccccc2C1=O

CAS 3409-21-0
Molecular Weight (g/mol) 203.2802
SMILES CN(C)CCC1Cc2ccccc2C1=O
Synonym 2-[2-(Dimethylamino)ethyl]-2,3-dihydro-1H-inden-1-one
IUPAC Name 2-[2-(dimethylamino)ethyl]-2,3-dihydroinden-1-one
Molecular Formula C13 H17 N O
6

3',4',7,8-Tetrahydroxyflavone, TRC

CAS: 3440-24-2 Molecular Formula: C15 H10 O6 Molecular Weight (g/mol): 286.24 IUPAC Name: 2-(3,4-dihydroxyphenyl)-7,8-dihydroxy-chromen-4-one SMILES: Oc1ccc(cc1O)C2=CC(=O)c3ccc(O)c(O)c3O2

CAS 3440-24-2
Molecular Weight (g/mol) 286.24
SMILES Oc1ccc(cc1O)C2=CC(=O)c3ccc(O)c(O)c3O2
IUPAC Name 2-(3,4-dihydroxyphenyl)-7,8-dihydroxy-chromen-4-one
Molecular Formula C15 H10 O6
7

Atipamezole, TRC

CAS: 104054-27-5 Molecular Formula: C14H16N2 Molecular Weight (g/mol): 212.29 Synonym: 4-(2-Ethyl-2,3-dihydro-1H-inden-2-yl)-1H-imidazole,MPV 1248 IUPAC Name: 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole SMILES: CCC1(C2=CN=CN2)CC3=CC=CC=C3C1

CAS 104054-27-5
Molecular Weight (g/mol) 212.29
SMILES CCC1(C2=CN=CN2)CC3=CC=CC=C3C1
Synonym 4-(2-Ethyl-2,3-dihydro-1H-inden-2-yl)-1H-imidazole,MPV 1248
IUPAC Name 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole
Molecular Formula C14H16N2
8

1-Aminoindane Hydrochloride, TRC

CAS: 70146-15-5 Molecular Formula: C9 H11 N . Cl H Molecular Weight (g/mol): 169.65 Synonym: 1H-Inden-1-amine, 2,3-dihydro-, hydrochloride (1:1),1-Indanamine, hydrochloride (6CI,7CI),1H-Inden-1-amine, 2,3-dihydro-, hydrochloride (9CI),1-Aminoindan hydrochloride,1-Aminoindane hydrochloride,NSC 186227,Indan-1-amine Hydrochloride IUPAC Name: 2,3-dihydro-1H-inden-1-amine;hydrochloride SMILES: Cl.NC1CCc2ccccc12

CAS 70146-15-5
Molecular Weight (g/mol) 169.65
SMILES Cl.NC1CCc2ccccc12
Synonym 1H-Inden-1-amine, 2,3-dihydro-, hydrochloride (1:1),1-Indanamine, hydrochloride (6CI,7CI),1H-Inden-1-amine, 2,3-dihydro-, hydrochloride (9CI),1-Aminoindan hydrochloride,1-Aminoindane hydrochloride,NSC 186227,Indan-1-amine Hydrochloride
IUPAC Name 2,3-dihydro-1H-inden-1-amine;hydrochloride
Molecular Formula C9 H11 N . Cl H
9

Anisindione, TRC

CAS: 117-37-3 Molecular Formula: C16 H12 O3 Molecular Weight (g/mol): 252.26 Synonym: 2-(4-Methoxyphenyl)-1H-Indene-1,3(2H)-dione,2-(p-Methoxyphenyl)-1,3-indandione,2-p-Anisyl-1,3-indandione,Andion,Miradon,SPE 2792,Unidone IUPAC Name: 2-(4-methoxyphenyl)indene-1,3-dione SMILES: COc1ccc(cc1)C2C(=O)c3ccccc3C2=O

CAS 117-37-3
Molecular Weight (g/mol) 252.26
SMILES COc1ccc(cc1)C2C(=O)c3ccccc3C2=O
Synonym 2-(4-Methoxyphenyl)-1H-Indene-1,3(2H)-dione,2-(p-Methoxyphenyl)-1,3-indandione,2-p-Anisyl-1,3-indandione,Andion,Miradon,SPE 2792,Unidone
IUPAC Name 2-(4-methoxyphenyl)indene-1,3-dione
Molecular Formula C16 H12 O3
10

Hematein (Technical Grade), TRC

CAS: 475-25-2 Molecular Formula: C16H12O6 Molecular Weight (g/mol): 300.28 Synonym: 6a,7-Dihydro-3,4,6a,10-tetrahydroxybenz[b]indeno[1,2-d]pyran-9(6H)-one,Haematein,NSC 7333 IUPAC Name: 3,4,6a,10-tetrahydroxy-6,7-dihydroindeno[2,1-c]chromen-9-one SMILES: OC1=CC2=C3c4ccc(O)c(O)c4OCC3(O)CC2=CC1=O

CAS 475-25-2
Molecular Weight (g/mol) 300.28
SMILES OC1=CC2=C3c4ccc(O)c(O)c4OCC3(O)CC2=CC1=O
Synonym 6a,7-Dihydro-3,4,6a,10-tetrahydroxybenz[b]indeno[1,2-d]pyran-9(6H)-one,Haematein,NSC 7333
IUPAC Name 3,4,6a,10-tetrahydroxy-6,7-dihydroindeno[2,1-c]chromen-9-one
Molecular Formula C16H12O6
11

Fadolmidine Hydrochloride, TRC

CAS: 189353-32-0 Molecular Formula: C13H15ClN2O Molecular Weight (g/mol): 250.72 Synonym: 2,3-Dihydro-3-(1H-imidazol-5-ylmethyl)-1H-Inden-5-ol Hydrochloride (1:1),4-(6-Hydroxyindan-1-ylmethyl)-1H-imidazole Monohydrochloride,4-(6-Hydroxyindan-1-ylmethyl)-1H-imidazolium Chloride,MPV 2426 SMILES: Cl.Oc1ccc2CCC(Cc3c[nH]cn3)c2c1

CAS 189353-32-0
Molecular Weight (g/mol) 250.72
SMILES Cl.Oc1ccc2CCC(Cc3c[nH]cn3)c2c1
Synonym 2,3-Dihydro-3-(1H-imidazol-5-ylmethyl)-1H-Inden-5-ol Hydrochloride (1:1),4-(6-Hydroxyindan-1-ylmethyl)-1H-imidazole Monohydrochloride,4-(6-Hydroxyindan-1-ylmethyl)-1H-imidazolium Chloride,MPV 2426
Molecular Formula C13H15ClN2O
12

Fluindione, TRC

CAS: 957-56-2 Molecular Formula: C15 H9 F O2 Molecular Weight (g/mol): 240.23 Synonym: 2-(4-Fluorophenyl)-1H-indene-1,3(2H)-dione,1,3-Indandione, 2-(p-fluorophenyl)- (6CI,7CI,8CI),2-(4-Fluorophenyl)-1H-indene-1,3(2H)-dione,2-(p-Fluorophenyl)-1,3-indandione,Fluindione,LM 123,Previscan IUPAC Name: 2-(4-fluorophenyl)indene-1,3-dione SMILES: Fc1ccc(cc1)C2C(=O)c3ccccc3C2=O

CAS 957-56-2
Molecular Weight (g/mol) 240.23
SMILES Fc1ccc(cc1)C2C(=O)c3ccccc3C2=O
Synonym 2-(4-Fluorophenyl)-1H-indene-1,3(2H)-dione,1,3-Indandione, 2-(p-fluorophenyl)- (6CI,7CI,8CI),2-(4-Fluorophenyl)-1H-indene-1,3(2H)-dione,2-(p-Fluorophenyl)-1,3-indandione,Fluindione,LM 123,Previscan
IUPAC Name 2-(4-fluorophenyl)indene-1,3-dione
Molecular Formula C15 H9 F O2
13

Ramelteon Metabolite M-II (mixture of R and S at the hydroxy position), TRC

CAS: 896736-21-3 Molecular Formula: C16 H21 N O3 Molecular Weight (g/mol): 275.34 Synonym: Ramelteon Metabolite M-Ii IUPAC Name: 2-hydroxy-N-[2-(2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl)ethyl]propanamide SMILES: CC(O)C(=O)NCCC1CCc2ccc3OCCc3c12

CAS 896736-21-3
Molecular Weight (g/mol) 275.34
SMILES CC(O)C(=O)NCCC1CCc2ccc3OCCc3c12
Synonym Ramelteon Metabolite M-Ii
IUPAC Name 2-hydroxy-N-[2-(2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl)ethyl]propanamide
Molecular Formula C16 H21 N O3
14

OctaInd, TRC

CAS: 1084889-51-9 Molecular Formula: C18 H12 Br8 Molecular Weight (g/mol): 867.5199 Synonym: OctaInd,1H-Indene, 4,5,6,7-tetrabromo-2,3-dihydro-1,1,3-trimethyl-3-(2,3,4,5-tetrabromophenyl)- IUPAC Name: 4,5,6,7-tetrabromo-1,1,3-trimethyl-3-(2,3,4,5-tetrabromophenyl)-2H-indene SMILES: CC1(C)CC(C)(c2cc(Br)c(Br)c(Br)c2Br)c3c(Br)c(Br)c(Br)c(Br)c13

CAS 1084889-51-9
Molecular Weight (g/mol) 867.5199
SMILES CC1(C)CC(C)(c2cc(Br)c(Br)c(Br)c2Br)c3c(Br)c(Br)c(Br)c(Br)c13
Synonym OctaInd,1H-Indene, 4,5,6,7-tetrabromo-2,3-dihydro-1,1,3-trimethyl-3-(2,3,4,5-tetrabromophenyl)-
IUPAC Name 4,5,6,7-tetrabromo-1,1,3-trimethyl-3-(2,3,4,5-tetrabromophenyl)-2H-indene
Molecular Formula C18 H12 Br8
15

Atipamezole Hydrochloride, TRC

CAS: 104075-48-1 Molecular Formula: C14 H16 N2 . Cl H Molecular Weight (g/mol): 248.75 Synonym: Atipamezole Hydrochloride,1H-Imidazole, 4-(2-ethyl-2,3-dihydro-1H-inden-2-yl)-, monohydrochloride (9CI),Antisedan,Atipamezole hydrochloride,1H-Imidazole, 5-(2-ethyl-2,3-dihydro-1H-inden-2-yl)-, hydrochloride (1:1),4-(2-Ethyl-2,3-dihydro-1H-inden-2-yl)-1H-imidazole monohydrochloride IUPAC Name: 4-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole;hydrochloride SMILES: Cl.CCC1(Cc2ccccc2C1)c3c[nH]cn3

CAS 104075-48-1
Molecular Weight (g/mol) 248.75
SMILES Cl.CCC1(Cc2ccccc2C1)c3c[nH]cn3
Synonym Atipamezole Hydrochloride,1H-Imidazole, 4-(2-ethyl-2,3-dihydro-1H-inden-2-yl)-, monohydrochloride (9CI),Antisedan,Atipamezole hydrochloride,1H-Imidazole, 5-(2-ethyl-2,3-dihydro-1H-inden-2-yl)-, hydrochloride (1:1),4-(2-Ethyl-2,3-dihydro-1H-inden-2-yl)-1H-imidazole monohydrochloride
IUPAC Name 4-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole;hydrochloride
Molecular Formula C14 H16 N2 . Cl H