2-(2-benzoylphenyl)acetyl chloride

C15H11ClO2 — CID 139777615

IUPAC2-(2-benzoylphenyl)acetyl chloride
SMILESO=C(Cl)Cc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C15H11ClO2/c16-14(17)10-12-8-4-5-9-13(12)15(18)11-6-2-1-3-7-11/h1-9H,10H2
InChIKeyQWHIXYSGWAJFEN-UHFFFAOYSA-N
MW258.70 g/mol
LogP3.23
Rot. Bonds4

About 2-(2-benzoylphenyl)acetyl chloride

2-(2-benzoylphenyl)acetyl chloride (PubChem CID 139777615) has the molecular formula C15H11ClO2 and a molecular weight of 258.70 g/mol. Its IUPAC name is 2-(2-benzoylphenyl)acetyl chloride.

Molecular Properties

Compound Name2-(2-benzoylphenyl)acetyl chloride
PubChem CID139777615
Molecular FormulaC15H11ClO2
Molecular Weight258.70 g/mol
Exact Mass258.04
IUPAC Name2-(2-benzoylphenyl)acetyl chloride
SMILESO=C(Cl)Cc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C15H11ClO2/c16-14(17)10-12-8-4-5-9-13(12)15(18)11-6-2-1-3-7-11/h1-9H,10H2
InChIKeyQWHIXYSGWAJFEN-UHFFFAOYSA-N
XLogP3.23
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.70
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}

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Related Compounds

sodium;(2-ethylphenyl)-phenylmethanone;hydride
CID 175475173
[2-(3-hydroxypropyl)phenyl]-phenylmethanone
CID 66892901
phenyl-(2-prop-2-enylphenyl)methanone
CID 12026554
2-[2-(4-fluorobenzoyl)phenyl]acetic acid
CID 132556862
[2-(10-chlorodecyl)phenyl]-phenylmethanone
CID 157301070
[2-(2,3-dihydroxypropyl)phenyl]-phenylmethanone
CID 174521590
2-(2-benzoylphenyl)-1-(2,3-dimethylphenyl)ethanone
CID 175001099
[2-(2-aminopropyl)phenyl]-phenylmethanone
CID 130367835
tetrakis(carbonochloridic acid);diphenylmethanone
CID 173240243
(2-chlorophenyl)-phenylmethanone;diphenylmethanone
CID 157388336
[2-(azetidin-1-ylmethyl)phenyl]-phenylmethanone
CID 24725290
phenyl-(2-tridecylphenyl)methanone
CID 159151783

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzoylphenyl)acetyl chloride?
The IUPAC name of 2-(2-benzoylphenyl)acetyl chloride (CID 139777615) is 2-(2-benzoylphenyl)acetyl chloride.
What is the SMILES notation for 2-(2-benzoylphenyl)acetyl chloride?
The canonical SMILES for 2-(2-benzoylphenyl)acetyl chloride is O=C(Cl)Cc1ccccc1C(=O)c1ccccc1.
What is the InChIKey of 2-(2-benzoylphenyl)acetyl chloride?
The InChIKey is QWHIXYSGWAJFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClO2/c16-14(17)10-12-8-4-5-9-13(12)15(18)11-6-2-1-3-7-11/h1-9H,10H2.
What are the key properties of 2-(2-benzoylphenyl)acetyl chloride?
2-(2-benzoylphenyl)acetyl chloride has a molecular weight of 258.70 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzoylphenyl)acetyl chloride is sourced from PubChem (CID 139777615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).