Desyl chloride

C₁₄H₁₁ClOCAS 447-31-4230.69 g/mol

Open in Covalent MOL file

Alkyl halide Ketone

Properties

Molecular formula: C₁₄H₁₁ClO
Molar mass: 230.69 g/mol
Exact mass: 230.0498 Da
Melting point: 68.5 °C
Boiling point: 150 °C (at 0.02 Torr)
logP: 3.85Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage90.9% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501

Identifiers

CAS number

447-31-4

SMILES

O=C(c1ccccc1)C(Cl)c1ccccc1

InChIKey

RXDYOLRABMJTEF-UHFFFAOYSA-N

InChI

InChI=1S/C14H11ClO/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names

Ethanone, 2-chloro-1,2-diphenyl-
Acetophenone, 2-chloro-2-phenyl-
2-Chloro-1,2-diphenylethanone
2-Chloro-2-phenylacetophenone
α-Chlorobenzyl phenyl ketone
1,2-Diphenyl-2-chloroethanone
α-Chloro-α-phenylacetophenone
α-Chlorodeoxybenzoin
NSC 2883
2-Chloro-1,2-diphenylethan-1-one

Reactions

DESYL CHLORIDE (Acetophenone, α-chloro-α-phenyl-)product

Work with Desyl chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2-Dichloroacetophenone2648-61-563 % similar Benzoin (organic compound)119-53-957 % similar 2-Bromo-1,2-diphenylethanone1484-50-057 % similar (±)-Benzoin579-44-257 % similar 2-Chloro-1-phenyl-1-propanone6084-17-957 % similar α-Chlorobenzeneacetyl chloride2912-62-155 % similar Chloro(phenyl)acetic acid4755-72-053 % similar Chalcone epoxide5411-12-153 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Diphenylacetyl chloride1871-76-7 1-(4-Chlorophenyl)-2-phenylethanone1889-71-0 4-Phenylphenacyl chloride635-84-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook