(5-chloro-2-hydroxyphenyl)-phenylmethanone

C13H9ClO2 — CID 6799

IUPAC(5-chloro-2-hydroxyphenyl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C13H9ClO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H
InChIKeyOMWSZDODENFLSV-UHFFFAOYSA-N
MW232.67 g/mol
LogP3.28
Rot. Bonds2

About (5-chloro-2-hydroxyphenyl)-phenylmethanone

(5-chloro-2-hydroxyphenyl)-phenylmethanone (PubChem CID 6799) has the molecular formula C13H9ClO2 and a molecular weight of 232.67 g/mol. Its IUPAC name is (5-chloro-2-hydroxyphenyl)-phenylmethanone.

Molecular Properties

Compound Name(5-chloro-2-hydroxyphenyl)-phenylmethanone
PubChem CID6799
Molecular FormulaC13H9ClO2
Molecular Weight232.67 g/mol
Exact Mass232.03
IUPAC Name(5-chloro-2-hydroxyphenyl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C13H9ClO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H
InChIKeyOMWSZDODENFLSV-UHFFFAOYSA-N
XLogP3.28
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.67
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-hydroxyphenyl)-phenylmethanone?
The IUPAC name of (5-chloro-2-hydroxyphenyl)-phenylmethanone (CID 6799) is (5-chloro-2-hydroxyphenyl)-phenylmethanone.
What is the SMILES notation for (5-chloro-2-hydroxyphenyl)-phenylmethanone?
The canonical SMILES for (5-chloro-2-hydroxyphenyl)-phenylmethanone is O=C(c1ccccc1)c1cc(Cl)ccc1O.
What is the InChIKey of (5-chloro-2-hydroxyphenyl)-phenylmethanone?
The InChIKey is OMWSZDODENFLSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H.
What are the key properties of (5-chloro-2-hydroxyphenyl)-phenylmethanone?
(5-chloro-2-hydroxyphenyl)-phenylmethanone has a molecular weight of 232.67 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-hydroxyphenyl)-phenylmethanone is sourced from PubChem (CID 6799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).