2′,6′-Dichloroacetophenone
Properties
- Molecular formula
- C8H6Cl2O
- Molar mass
- 189.03 g/mol
- Exact mass
- 187.9796 Da
- Melting point
- 42–43 °C
- Boiling point
- 140–141 °C (at 24 Torr)
- logP
- 3.20Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98.7% of notifiers
Aggregated from 75 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2040-05-3SMILES
CC(=O)c1c(Cl)cccc1ClInChIKey
HYBDSXBLGCQKRE-UHFFFAOYSA-NInChI
InChI=1S/C8H6Cl2O/c1-5(11)8-6(9)3-2-4-7(8)10/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 2',6'-Dichloroacetophenone
- 1-(2,6-Dichlorophenyl)ethanone
- Ethanone, 1-(2,6-dichlorophenyl)-
- Acetophenone, 2′,6′-dichloro-
- 1-(2,6-Dichlorophenyl)ethan-1-one
Work with 2′,6′-Dichloroacetophenone
Similar compounds
2'-Chloro-6'-fluoroacetophenone87327-69-371 % similar
2′-Chloroacetophenone2142-68-963 % similar
1-(2,3-Dichlorophenyl)ethanone56041-57-759 % similar
1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)ethanone175205-88-658 % similar
1-(2,6-Dichloro-3-fluorophenyl)ethanone290835-85-756 % similar
1-(3-Chloro-2-fluorophenyl)ethan-1-one161957-59-155 % similar
1,3-Diacetylbenzene6781-42-654 % similar
1-(2,6-Difluorophenyl)ethanone13670-99-054 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds