(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone

C13H8Cl2O2 — CID 12639783

IUPAC(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone
SMILESO=C(c1cccc(O)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2O2/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,16H
InChIKeyUSCNAMXMLGDKMW-UHFFFAOYSA-N
MW267.11 g/mol
LogP3.93
Rot. Bonds2

About (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone

(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone (PubChem CID 12639783) has the molecular formula C13H8Cl2O2 and a molecular weight of 267.11 g/mol. Its IUPAC name is (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone.

Molecular Properties

Compound Name(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone
PubChem CID12639783
Molecular FormulaC13H8Cl2O2
Molecular Weight267.11 g/mol
Exact Mass265.99
IUPAC Name(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone
SMILESO=C(c1cccc(O)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2O2/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,16H
InChIKeyUSCNAMXMLGDKMW-UHFFFAOYSA-N
XLogP3.93
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.11
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(3-chloro-4-hydroxyphenyl)phenyl]-(3-hydroxyphenyl)methanone
CID 56969694
(3,4-dihydroxyphenyl)-(3-hydroxyphenyl)methanone
CID 19931688
(3,4-dichlorophenyl)-(2,6-difluorophenyl)methanone
CID 43167216
(3,4-dihydroxyphenyl)-(3-hydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(4-hydroxyphenyl)methanone
CID 19931686
1,2-bis(3-hydroxyphenyl)ethane-1,2-dione
CID 13158606
(3,4-dichlorophenyl)-(3,5-difluorophenyl)methanone
CID 2758085
(3,4-dichlorophenyl)-(3,5-dimethylphenyl)methanone
CID 2758091
3,4-dichloro-N-[(3-hydroxyphenyl)methyl]benzamide
CID 47292199
[4-(4-hydroxyphenoxy)phenyl]-(3-hydroxyphenyl)methanone
CID 86171733
acetic acid;(3-hydroxyphenyl)-[4-(4-hydroxyphenyl)phenyl]methanone
CID 86741070
(3,4-dichlorophenyl)-(4-methoxyphenyl)methanone
CID 2758123
methyl 4-[4-(3,4-dichlorobenzoyl)benzoyl]benzoate
CID 10409472

Frequently Asked Questions

What is the IUPAC name of (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone?
The IUPAC name of (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone (CID 12639783) is (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone.
What is the SMILES notation for (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone?
The canonical SMILES for (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone is O=C(c1cccc(O)c1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone?
The InChIKey is USCNAMXMLGDKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2O2/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,16H.
What are the key properties of (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone?
(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone has a molecular weight of 267.11 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone is sourced from PubChem (CID 12639783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).