2-chloro-2,2-diphenylacetyl chloride

C14H10Cl2O — CID 17941

IUPAC2-chloro-2,2-diphenylacetyl chloride
SMILESO=C(Cl)C(Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H10Cl2O/c15-13(17)14(16,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyNFHKZAUDRWRXMZ-UHFFFAOYSA-N
MW265.14 g/mol
LogP3.93
Rot. Bonds3

About 2-chloro-2,2-diphenylacetyl chloride

2-chloro-2,2-diphenylacetyl chloride (PubChem CID 17941) has the molecular formula C14H10Cl2O and a molecular weight of 265.14 g/mol. Its IUPAC name is 2-chloro-2,2-diphenylacetyl chloride.

Molecular Properties

Compound Name2-chloro-2,2-diphenylacetyl chloride
PubChem CID17941
Molecular FormulaC14H10Cl2O
Molecular Weight265.14 g/mol
Exact Mass264.01
IUPAC Name2-chloro-2,2-diphenylacetyl chloride
SMILESO=C(Cl)C(Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H10Cl2O/c15-13(17)14(16,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyNFHKZAUDRWRXMZ-UHFFFAOYSA-N
XLogP3.93
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Phenylacetyl chloride
CID 7679
Benzenepropanoyl chloride
CID 64801
2,2-Diphenylacetyl chloride
CID 74637
Chloro(phenyl)acetyl chloride
CID 102902
2,2,2-Triphenylacetyl chloride
CID 347201
[1,1'-Biphenyl]-4,4'-dicarbonyl dichloride
CID 75374
4-Phenylbenzoyl chloride
CID 84151
trans-2-Phenyl-1-cyclopropanecarbonyl chloride
CID 13656
2-Chloro-2-phenylpropanal
CID 353469
2-Phenylbutyryl chloride
CID 98173
2,3-Dichloro-1,3-diphenylpropan-1-one
CID 230205
2-(Naphthalen-1-yl)acetyl chloride
CID 2795386

Frequently Asked Questions

What is the IUPAC name of 2-chloro-2,2-diphenylacetyl chloride?
The IUPAC name of 2-chloro-2,2-diphenylacetyl chloride (CID 17941) is 2-chloro-2,2-diphenylacetyl chloride.
What is the SMILES notation for 2-chloro-2,2-diphenylacetyl chloride?
The canonical SMILES for 2-chloro-2,2-diphenylacetyl chloride is O=C(Cl)C(Cl)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-chloro-2,2-diphenylacetyl chloride?
The InChIKey is NFHKZAUDRWRXMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2O/c15-13(17)14(16,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 2-chloro-2,2-diphenylacetyl chloride?
2-chloro-2,2-diphenylacetyl chloride has a molecular weight of 265.14 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2,2-diphenylacetyl chloride is sourced from PubChem (CID 17941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).