chempirical

2-Iodobenzoyl chloride

C7H4ClIOCAS 609-67-6266.46 g/mol

Open in Covalent MOL file
OClI
Acyl halideAryl halide

Properties

Molecular formula
C7H4ClIO
Molar mass
266.46 g/mol
Exact mass
265.8995 Da
Melting point
35–40 °C
Boiling point
106–108 °C (at 0.2 Torr)
logP
2.67Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
609-67-6
SMILES
O=C(Cl)c1ccccc1I
InChIKey
MVIVDSWUOGNODP-UHFFFAOYSA-N
InChI
InChI=1S/C7H4ClIO/c8-7(10)5-3-1-2-4-6(5)9/h1-4H

Weigh it out

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

Names and synonyms

4 names
  • Benzoyl chloride, 2-iodo-
  • Benzoyl chloride, o-iodo-
  • o-Iodobenzoyl chloride
  • 2-Iodobenzoic acid chloride

Work with 2-Iodobenzoyl 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

Phthaloyl chloride88-95-967 % similar 2-Methylbenzoyl chloride933-88-059 % similar 2-Chlorobenzoyl chloride609-65-455 % similar 2-Bromobenzoyl chloride7154-66-755 % similar 2-Fluorobenzoyl chloride393-52-253 % similar 2-Iodobenzoic acid88-67-553 % similar 1-Naphthoyl chloride879-18-552 % similar 2-(Chloromethyl)benzoyl chloride42908-86-150 % similar

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

Same formula

4-Iodobenzoyl chloride1711-02-0 3-Iodobenzoyl chloride1711-10-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook