1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone

C14H10Cl2O2 — CID 21163872

IUPAC1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone
SMILESO=C(c1cccc(Cl)c1Cl)C(O)c1ccccc1
InChIInChI=1S/C14H10Cl2O2/c15-11-8-4-7-10(12(11)16)14(18)13(17)9-5-2-1-3-6-9/h1-8,13,17H
InChIKeyCXQSYLGTYRSOPX-UHFFFAOYSA-N
MW281.14 g/mol
LogP3.91
Rot. Bonds3

About 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone

1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone (PubChem CID 21163872) has the molecular formula C14H10Cl2O2 and a molecular weight of 281.14 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone
PubChem CID21163872
Molecular FormulaC14H10Cl2O2
Molecular Weight281.14 g/mol
Exact Mass280.01
IUPAC Name1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone
SMILESO=C(c1cccc(Cl)c1Cl)C(O)c1ccccc1
InChIInChI=1S/C14H10Cl2O2/c15-11-8-4-7-10(12(11)16)14(18)13(17)9-5-2-1-3-6-9/h1-8,13,17H
InChIKeyCXQSYLGTYRSOPX-UHFFFAOYSA-N
XLogP3.91
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.14
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-hydroxy-2-phenylacetyl)phenyl]acetic acid
CID 69479306
1,2-bis(2-chlorophenyl)ethane-1,2-dione;1-(2,3-dichlorophenyl)-2-phenylethane-1,2-dione
CID 69255292
1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone
CID 18330797
2-hydroxy-1-[2-(methylamino)phenyl]-2-phenylethanone
CID 67016946
1-(2-amino-4-chlorophenyl)-2-hydroxy-2-phenylethanone
CID 67942436
2-hydroxy-1,2-diphenylethanone
CID 159399559
1-(7-chloro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone
CID 103458183
1-(2-fluoro-3-methoxyphenyl)-2-hydroxy-2-phenylethanone
CID 103458248
2-hydroxy-1-isoquinolin-8-yl-2-phenylethanone
CID 103458218
(2R)-1-(1,2-dihydroacenaphthylen-5-yl)-2-hydroxy-2-phenylethanone
CID 7053397
2,3-dichloro-N-sulfanylbenzamide
CID 71773851
(2,3-dichlorophenyl) 2,2-diphenylacetate
CID 5086798

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone?
The IUPAC name of 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone (CID 21163872) is 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone?
The canonical SMILES for 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone is O=C(c1cccc(Cl)c1Cl)C(O)c1ccccc1.
What is the InChIKey of 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone?
The InChIKey is CXQSYLGTYRSOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2O2/c15-11-8-4-7-10(12(11)16)14(18)13(17)9-5-2-1-3-6-9/h1-8,13,17H.
What are the key properties of 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone?
1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone has a molecular weight of 281.14 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone is sourced from PubChem (CID 21163872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).