1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol

C18H19ClO — CID 115803551

IUPAC1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol
SMILESCc1ccc(C(O)Cc2ccc3c(c2)CCC3)cc1Cl
InChIInChI=1S/C18H19ClO/c1-12-5-7-16(11-17(12)19)18(20)10-13-6-8-14-3-2-4-15(14)9-13/h5-9,11,18,20H,2-4,10H2,1H3
InChIKeyRZGYSCUOJGJZOS-UHFFFAOYSA-N
MW286.80 g/mol
LogP4.41
Rot. Bonds3

About 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol

1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol (PubChem CID 115803551) has the molecular formula C18H19ClO and a molecular weight of 286.80 g/mol. Its IUPAC name is 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol.

Molecular Properties

Compound Name1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol
PubChem CID115803551
Molecular FormulaC18H19ClO
Molecular Weight286.80 g/mol
Exact Mass286.11
IUPAC Name1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol
SMILESCc1ccc(C(O)Cc2ccc3c(c2)CCC3)cc1Cl
InChIInChI=1S/C18H19ClO/c1-12-5-7-16(11-17(12)19)18(20)10-13-6-8-14-3-2-4-15(14)9-13/h5-9,11,18,20H,2-4,10H2,1H3
InChIKeyRZGYSCUOJGJZOS-UHFFFAOYSA-N
XLogP4.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.80
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-bromophenyl)-1-(3-chloro-4-methylphenyl)ethanol
CID 63519474
2-(3-chlorophenyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 62503763
1-(5-bromo-2-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 115803352
2-(2,3-dihydro-1H-inden-5-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105101576
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 65101112
6-[1-chloro-2-(3,4-dimethylphenyl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 63431085
2-(2,3-dihydro-1H-inden-5-yl)-1-(3,4-dimethylphenyl)ethanamine
CID 115864878
6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene
CID 82255501
1-(3-chloro-4-methylphenyl)-3-(4-methylphenyl)propan-1-ol
CID 107562190
1-(3-chloro-4-methylphenyl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 115822386
1-(3-chloro-4-methylphenyl)-2-cycloheptylethanol
CID 107562179
1-(3,4-dihydro-2H-chromen-6-yl)-2-(3,4-dimethylphenyl)ethanol
CID 62538318

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol?
The IUPAC name of 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol (CID 115803551) is 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol.
What is the SMILES notation for 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol?
The canonical SMILES for 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol is Cc1ccc(C(O)Cc2ccc3c(c2)CCC3)cc1Cl.
What is the InChIKey of 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol?
The InChIKey is RZGYSCUOJGJZOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClO/c1-12-5-7-16(11-17(12)19)18(20)10-13-6-8-14-3-2-4-15(14)9-13/h5-9,11,18,20H,2-4,10H2,1H3.
What are the key properties of 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol?
1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol has a molecular weight of 286.80 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methylphenyl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol is sourced from PubChem (CID 115803551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).