2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol

C16H17ClO2 — CID 61081069

IUPAC2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccccc2Cl)cc1C
InChIInChI=1S/C16H17ClO2/c1-11-9-13(7-8-16(11)19-2)15(18)10-12-5-3-4-6-14(12)17/h3-9,15,18H,10H2,1-2H3
InChIKeyCKHQNVZHICYKIS-UHFFFAOYSA-N
MW276.76 g/mol
LogP3.93
Rot. Bonds4

About 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol

2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol (PubChem CID 61081069) has the molecular formula C16H17ClO2 and a molecular weight of 276.76 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol
PubChem CID61081069
Molecular FormulaC16H17ClO2
Molecular Weight276.76 g/mol
Exact Mass276.09
IUPAC Name2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccccc2Cl)cc1C
InChIInChI=1S/C16H17ClO2/c1-11-9-13(7-8-16(11)19-2)15(18)10-12-5-3-4-6-14(12)17/h3-9,15,18H,10H2,1-2H3
InChIKeyCKHQNVZHICYKIS-UHFFFAOYSA-N
XLogP3.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.76
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chloro-4-methylphenyl)-2-(2-methoxyphenyl)ethanol
CID 55162570
1-(4-bromo-3-methylphenyl)-2-(2-chlorophenyl)ethanol
CID 81447481
2-(2-bromophenyl)-1-(3-chloro-4-methoxyphenyl)ethanol
CID 65026534
2-(3-chloro-2-fluorophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 102867481
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 107307527
1-(4-methoxy-3-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 61080511
2-(2-chlorophenyl)-1-naphthalen-2-ylethanol
CID 62715892
2-(2-bromo-5-methoxyphenyl)-1-(4-methoxy-3-methylphenyl)ethanol
CID 65327757
2-(4-bromophenyl)-1-(4-methoxy-3-methylphenyl)ethanol
CID 61081846
2-(2-bromophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 114977277
[2-(2-chlorophenyl)-1-(4-methoxy-2,5-dimethylphenyl)ethyl]hydrazine
CID 105209646
(1S)-1-(4-methoxy-3-methylphenyl)butan-1-ol
CID 39239112

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol?
The IUPAC name of 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol (CID 61081069) is 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol?
The canonical SMILES for 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol is COc1ccc(C(O)Cc2ccccc2Cl)cc1C.
What is the InChIKey of 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol?
The InChIKey is CKHQNVZHICYKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO2/c1-11-9-13(7-8-16(11)19-2)15(18)10-12-5-3-4-6-14(12)17/h3-9,15,18H,10H2,1-2H3.
What are the key properties of 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol?
2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol has a molecular weight of 276.76 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)ethanol is sourced from PubChem (CID 61081069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).