1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone

C14H9Cl3O — CID 107307846

IUPAC1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1ccccc1Cl
InChIInChI=1S/C14H9Cl3O/c15-11-6-2-1-5-10(11)13(18)8-9-4-3-7-12(16)14(9)17/h1-7H,8H2
InChIKeyJZCIPYIYDKNTOP-UHFFFAOYSA-N
MW299.58 g/mol
LogP5.07
Rot. Bonds3

About 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone

1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone (PubChem CID 107307846) has the molecular formula C14H9Cl3O and a molecular weight of 299.58 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone
PubChem CID107307846
Molecular FormulaC14H9Cl3O
Molecular Weight299.58 g/mol
Exact Mass297.97
IUPAC Name1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1ccccc1Cl
InChIInChI=1S/C14H9Cl3O/c15-11-6-2-1-5-10(11)13(18)8-9-4-3-7-12(16)14(9)17/h1-7H,8H2
InChIKeyJZCIPYIYDKNTOP-UHFFFAOYSA-N
XLogP5.07
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.58
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chloro-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanone
CID 82802165
2-(2,3-dichlorophenyl)-1-quinolin-8-ylethanone
CID 107311695
2-(2,3-dichlorophenyl)-1-(2,3-dimethoxyphenyl)ethanone
CID 107311518
1-(2-chlorophenyl)-2-(2-methoxyphenyl)ethanone
CID 61077883
2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
CID 107311580
1-(2-chlorophenyl)-2-quinolin-5-ylethanone;hydrobromide
CID 173164108
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-pyridinyl)ethanone
CID 107307992
1-(4-aminophenyl)-2-(2,3-dichlorophenyl)ethanone
CID 107308085
2-(2,3-dichlorophenyl)-1-(4-iodophenyl)ethanone
CID 107311673
1-(2-chlorophenyl)-2-phosphanylethanone
CID 144986578
2-(4-chloro-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanone
CID 115815728
1-(2,3-dichlorophenyl)-2-(2,5-dimethylphenyl)ethanone
CID 63527350

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone?
The IUPAC name of 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone (CID 107307846) is 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone.
What is the SMILES notation for 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone?
The canonical SMILES for 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone is O=C(Cc1cccc(Cl)c1Cl)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone?
The InChIKey is JZCIPYIYDKNTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl3O/c15-11-6-2-1-5-10(11)13(18)8-9-4-3-7-12(16)14(9)17/h1-7H,8H2.
What are the key properties of 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone?
1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone has a molecular weight of 299.58 g/mol, XLogP of 5.07, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone is sourced from PubChem (CID 107307846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).