2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol

C16H17ClO2 — CID 61081695

IUPAC2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)Cc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClO2/c1-11-3-8-16(19-2)14(9-11)15(18)10-12-4-6-13(17)7-5-12/h3-9,15,18H,10H2,1-2H3
InChIKeyYZLQWKQBQJYZOH-UHFFFAOYSA-N
MW276.76 g/mol
LogP3.93
Rot. Bonds4

About 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol

2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 61081695) has the molecular formula C16H17ClO2 and a molecular weight of 276.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
PubChem CID61081695
Molecular FormulaC16H17ClO2
Molecular Weight276.76 g/mol
Exact Mass276.09
IUPAC Name2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)Cc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClO2/c1-11-3-8-16(19-2)14(9-11)15(18)10-12-4-6-13(17)7-5-12/h3-9,15,18H,10H2,1-2H3
InChIKeyYZLQWKQBQJYZOH-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

2-(4-bromophenyl)-1-(5-chloro-2-methoxyphenyl)ethanol
CID 62790115
2-(3-bromo-4-methoxyphenyl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 115779535
1-(5-chloro-2-methoxyphenyl)-2-(4-iodophenyl)ethanol
CID 115802739
1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
1-(4-chlorophenyl)-3-(2-methoxy-5-methylphenyl)propan-2-ol
CID 62161181
2-(4-chlorophenyl)-N-ethyl-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43626354
1-(5-chloro-2-methoxyphenyl)-2-pyridin-4-ylethanol
CID 55116184
1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
2-(5-bromo-2-fluorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 115784994
2-(4-chlorophenyl)-1-(2-fluoro-3-methoxyphenyl)ethanol
CID 82807893
1-(2-amino-3-methoxyphenyl)-2-(4-chlorophenyl)ethanol
CID 107469515
1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol
CID 62865520

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol (CID 61081695) is 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol is COc1ccc(C)cc1C(O)Cc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is YZLQWKQBQJYZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO2/c1-11-3-8-16(19-2)14(9-11)15(18)10-12-4-6-13(17)7-5-12/h3-9,15,18H,10H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol?
2-(4-chlorophenyl)-1-(2-methoxy-5-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-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 61081695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).