[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone

C19H13ClO3 — CID 56969694

IUPAC[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(-c2ccc(O)c(Cl)c2)cc1)c1cccc(O)c1
InChIInChI=1S/C19H13ClO3/c20-17-11-14(8-9-18(17)22)12-4-6-13(7-5-12)19(23)15-2-1-3-16(21)10-15/h1-11,21-22H
InChIKeyKHDREIFFVIZQAM-UHFFFAOYSA-N
MW324.76 g/mol
LogP4.65
Rot. Bonds3

About [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone

[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone (PubChem CID 56969694) has the molecular formula C19H13ClO3 and a molecular weight of 324.76 g/mol. Its IUPAC name is [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone
PubChem CID56969694
Molecular FormulaC19H13ClO3
Molecular Weight324.76 g/mol
Exact Mass324.06
IUPAC Name[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(-c2ccc(O)c(Cl)c2)cc1)c1cccc(O)c1
InChIInChI=1S/C19H13ClO3/c20-17-11-14(8-9-18(17)22)12-4-6-13(7-5-12)19(23)15-2-1-3-16(21)10-15/h1-11,21-22H
InChIKeyKHDREIFFVIZQAM-UHFFFAOYSA-N
XLogP4.65
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.76
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone?
The IUPAC name of [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone (CID 56969694) is [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone.
What is the SMILES notation for [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone?
The canonical SMILES for [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone is O=C(c1ccc(-c2ccc(O)c(Cl)c2)cc1)c1cccc(O)c1.
What is the InChIKey of [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone?
The InChIKey is KHDREIFFVIZQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClO3/c20-17-11-14(8-9-18(17)22)12-4-6-13(7-5-12)19(23)15-2-1-3-16(21)10-15/h1-11,21-22H.
What are the key properties of [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone?
[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone has a molecular weight of 324.76 g/mol, XLogP of 4.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone is sourced from PubChem (CID 56969694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).