1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol

C15H15ClO2 — CID 60794949

IUPAC1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(C)(O)c2ccccc2Cl)cc1
InChIInChI=1S/C15H15ClO2/c1-15(17,13-5-3-4-6-14(13)16)11-7-9-12(18-2)10-8-11/h3-10,17H,1-2H3
InChIKeyOGASGJVPDFMBIR-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.60
Rot. Bonds3

About 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol

1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol (PubChem CID 60794949) has the molecular formula C15H15ClO2 and a molecular weight of 262.74 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol
PubChem CID60794949
Molecular FormulaC15H15ClO2
Molecular Weight262.74 g/mol
Exact Mass262.08
IUPAC Name1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(C)(O)c2ccccc2Cl)cc1
InChIInChI=1S/C15H15ClO2/c1-15(17,13-5-3-4-6-14(13)16)11-7-9-12(18-2)10-8-11/h3-10,17H,1-2H3
InChIKeyOGASGJVPDFMBIR-UHFFFAOYSA-N
XLogP3.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol?
The IUPAC name of 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol (CID 60794949) is 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol is COc1ccc(C(C)(O)c2ccccc2Cl)cc1.
What is the InChIKey of 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol?
The InChIKey is OGASGJVPDFMBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClO2/c1-15(17,13-5-3-4-6-14(13)16)11-7-9-12(18-2)10-8-11/h3-10,17H,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol?
1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol has a molecular weight of 262.74 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-1-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 60794949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).