(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone

C13H7Cl3O2 — CID 58962676

IUPAC(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C13H7Cl3O2/c14-8-1-2-12(17)11(6-8)13(18)7-3-9(15)5-10(16)4-7/h1-6,17H
InChIKeyNIFPFORIULRSRR-UHFFFAOYSA-N
MW301.56 g/mol
LogP4.58
Rot. Bonds2

About (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone

(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone (PubChem CID 58962676) has the molecular formula C13H7Cl3O2 and a molecular weight of 301.56 g/mol. Its IUPAC name is (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone
PubChem CID58962676
Molecular FormulaC13H7Cl3O2
Molecular Weight301.56 g/mol
Exact Mass299.95
IUPAC Name(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C13H7Cl3O2/c14-8-1-2-12(17)11(6-8)13(18)7-3-9(15)5-10(16)4-7/h1-6,17H
InChIKeyNIFPFORIULRSRR-UHFFFAOYSA-N
XLogP4.58
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.56
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-2-hydroxyphenyl)-(3-chloro-5-methylphenyl)methanone
CID 11594340
5-chloro-2-hydroxybenzenecarbothioic S-acid;zinc
CID 88741905
calcium;5-chloro-2-hydroxybenzoic acid;hydride
CID 174504492
(5-chloro-2-hydroxyphenyl)-(2-methylphenyl)methanone
CID 21463072
(3-chlorophenyl)-(4,5-dichloro-2-hydroxyphenyl)methanone
CID 70624009
(5-chloro-2-hydroxyphenyl)-[3-(trifluoromethylsulfanyl)phenyl]methanone
CID 58962464
5-(5-chloro-2-hydroxybenzoyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 2537858
5-chloro-2-hydroxy-N-sulfanylbenzamide
CID 130240285
(5-chloro-2-hydroxyphenyl)-[6-(4-methylphenyl)-3-pyridinyl]methanone
CID 153408167
(5-chloro-2-hydroxyphenyl)-[4-hydroxy-3-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)phenyl]methanone
CID 139223403
(5-chloro-2-hydroxyphenyl)-(1-pyrimidin-2-ylpyrazol-4-yl)methanone
CID 47058395
(2,5-dichlorophenyl)-(3,5-dimethylphenyl)methanone
CID 43344611

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone?
The IUPAC name of (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone (CID 58962676) is (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone.
What is the SMILES notation for (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone?
The canonical SMILES for (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone is O=C(c1cc(Cl)cc(Cl)c1)c1cc(Cl)ccc1O.
What is the InChIKey of (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone?
The InChIKey is NIFPFORIULRSRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl3O2/c14-8-1-2-12(17)11(6-8)13(18)7-3-9(15)5-10(16)4-7/h1-6,17H.
What are the key properties of (5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone?
(5-chloro-2-hydroxyphenyl)-(3,5-dichlorophenyl)methanone has a molecular weight of 301.56 g/mol, XLogP of 4.58, 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)-(3,5-dichlorophenyl)methanone is sourced from PubChem (CID 58962676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).