1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol

C15H14Cl2O — CID 62790994

IUPAC1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C15H14Cl2O/c1-10-5-7-11(8-6-10)9-14(18)12-3-2-4-13(16)15(12)17/h2-8,14,18H,9H2,1H3
InChIKeyKXHWQCZKQRPFQC-UHFFFAOYSA-N
MW281.18 g/mol
LogP4.58
Rot. Bonds3

About 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol

1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol (PubChem CID 62790994) has the molecular formula C15H14Cl2O and a molecular weight of 281.18 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol
PubChem CID62790994
Molecular FormulaC15H14Cl2O
Molecular Weight281.18 g/mol
Exact Mass280.04
IUPAC Name1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol
SMILESCc1ccc(CC(O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C15H14Cl2O/c1-10-5-7-11(8-6-10)9-14(18)12-3-2-4-13(16)15(12)17/h2-8,14,18H,9H2,1H3
InChIKeyKXHWQCZKQRPFQC-UHFFFAOYSA-N
XLogP4.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.18
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dichlorophenyl)-2-(3-methylphenyl)ethanol
CID 62792001
(1R)-1-(2,3-dichlorophenyl)-2-pyridin-4-ylethanol
CID 129368105
2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 107883512
1-(2,3-dichlorophenyl)-3-methylbutan-1-ol
CID 62789609
1-(2,3-dichlorophenyl)-2-(1-methylpyrazol-4-yl)ethanol
CID 63895824
1-(2-chlorophenyl)-3-(4-methylphenyl)propan-1-ol
CID 105079773
1-(2-chloro-4-methylphenyl)-2-(2,3-dichlorophenyl)ethanol
CID 107312550
1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
1-(3-chloro-2-fluorophenyl)-2-(4-ethylphenyl)ethanol
CID 64712768
1-(2,3-dichlorophenyl)-2-(2,4-dichlorophenyl)ethanol
CID 55187922
3-amino-1-(2,3-dichlorophenyl)-2-(4-methylphenyl)propan-1-ol
CID 65187784
4-amino-1-(2,3-dichlorophenyl)butan-1-ol
CID 54426127

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol?
The IUPAC name of 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol (CID 62790994) is 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol?
The canonical SMILES for 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol is Cc1ccc(CC(O)c2cccc(Cl)c2Cl)cc1.
What is the InChIKey of 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol?
The InChIKey is KXHWQCZKQRPFQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O/c1-10-5-7-11(8-6-10)9-14(18)12-3-2-4-13(16)15(12)17/h2-8,14,18H,9H2,1H3.
What are the key properties of 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol?
1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol has a molecular weight of 281.18 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol is sourced from PubChem (CID 62790994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).