[3-(2-chlorophenyl)-5-methoxyphenyl]methanol

C14H13ClO2 — CID 123183360

IUPAC[3-(2-chlorophenyl)-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)cc(-c2ccccc2Cl)c1
InChIInChI=1S/C14H13ClO2/c1-17-12-7-10(9-16)6-11(8-12)13-4-2-3-5-14(13)15/h2-8,16H,9H2,1H3
InChIKeyIFIIYGYREIXDNN-UHFFFAOYSA-N
MW248.71 g/mol
LogP3.51
Rot. Bonds3

About [3-(2-chlorophenyl)-5-methoxyphenyl]methanol

[3-(2-chlorophenyl)-5-methoxyphenyl]methanol (PubChem CID 123183360) has the molecular formula C14H13ClO2 and a molecular weight of 248.71 g/mol. Its IUPAC name is [3-(2-chlorophenyl)-5-methoxyphenyl]methanol.

Molecular Properties

Compound Name[3-(2-chlorophenyl)-5-methoxyphenyl]methanol
PubChem CID123183360
Molecular FormulaC14H13ClO2
Molecular Weight248.71 g/mol
Exact Mass248.06
IUPAC Name[3-(2-chlorophenyl)-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)cc(-c2ccccc2Cl)c1
InChIInChI=1S/C14H13ClO2/c1-17-12-7-10(9-16)6-11(8-12)13-4-2-3-5-14(13)15/h2-8,16H,9H2,1H3
InChIKeyIFIIYGYREIXDNN-UHFFFAOYSA-N
XLogP3.51
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.71
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The IUPAC name of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol (CID 123183360) is [3-(2-chlorophenyl)-5-methoxyphenyl]methanol.
What is the SMILES notation for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The canonical SMILES for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol is COc1cc(CO)cc(-c2ccccc2Cl)c1.
What is the InChIKey of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
The InChIKey is IFIIYGYREIXDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClO2/c1-17-12-7-10(9-16)6-11(8-12)13-4-2-3-5-14(13)15/h2-8,16H,9H2,1H3.
What are the key properties of [3-(2-chlorophenyl)-5-methoxyphenyl]methanol?
[3-(2-chlorophenyl)-5-methoxyphenyl]methanol has a molecular weight of 248.71 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-chlorophenyl)-5-methoxyphenyl]methanol is sourced from PubChem (CID 123183360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).