2-(Chloromethyl)benzoyl chloride
Properties
- Molecular formula
- C8H6Cl2O
- Molar mass
- 189.03 g/mol
- Exact mass
- 187.9796 Da
- Boiling point
- 135 °C (at 14 Torr)
- logP
- 2.80Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 2
Hazards
Danger
- H302 Harmful if swallowed97.4% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
- H331 Toxic if inhaled97.4% of notifiers
- H351 Suspected of causing cancer97.4% of notifiers
Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P321, P330, P363, P403+P233, P405, P501
Identifiers
CAS number
42908-86-1SMILES
O=C(Cl)c1ccccc1CClInChIKey
TXZFBHYDQGYOIT-UHFFFAOYSA-NInChI
InChI=1S/C8H6Cl2O/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4H,5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzoyl chloride, 2-(chloromethyl)-
- o-Toluoyl chloride, α-chloro-
- o-Chloromethylbenzoyl chloride
Work with 2-(Chloromethyl)benzoyl chloride
Similar compounds
Phthaloyl chloride88-95-962 % similar
2-(Chloromethyl)benzoic acid85888-81-959 % similar
2-Chlorobenzoyl chloride609-65-452 % similar
2-Bromobenzoyl chloride7154-66-752 % similar
2-Fluorobenzoyl chloride393-52-250 % similar
2-Iodobenzoyl chloride609-67-650 % similar
α,α′-Dichloro-o-xylene612-12-450 % similar
2-Methylbenzoyl chloride933-88-050 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.