2-Chloro-1-(3,4-difluorophenyl)ethanone
Properties
- Molecular formula
- C8H5ClF2O
- Molar mass
- 190.57 g/mol
- Exact mass
- 189.9997 Da
- Melting point
- 31–32 °C
- logP
- 2.39Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 2
Hazards
Danger
- H290 May be corrosive to metals20% of notifiers
- H301 Toxic if swallowed20% of notifiers
- H302 Harmful if swallowed20% of notifiers
- H312 Harmful in contact with skin20% of notifiers
- H314 Causes severe skin burns and eye damage80% of notifiers
- H315 Causes skin irritation20% of notifiers
- H317 May cause an allergic skin reaction20% of notifiers
- H318 Causes serious eye damage40% of notifiers
- H319 Causes serious eye irritation20% of notifiers
- H332 Harmful if inhaled20% of notifiers
- H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled20% of notifiers
- H335 May cause respiratory irritation60% of notifiers
Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P233, P234, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P363, P390, P403, P403+P233, P405, P406, P501
Identifiers
CAS number
51336-95-9SMILES
O=C(CCl)c1ccc(F)c(F)c1InChIKey
VMEDAWUIKFAFJQ-UHFFFAOYSA-NInChI
InChI=1S/C8H5ClF2O/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3H,4H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Ethanone, 2-chloro-1-(3,4-difluorophenyl)-
- 2-Chloro-3′,4′-difluoroacetophenone
- 2-Chloro-1-(3,4-difluorophenyl)ethan-1-one
Work with 2-Chloro-1-(3,4-difluorophenyl)ethanone
Similar compounds
1-(3,4-Difluorophenyl)-1-propanone23384-72-764 % similar
2-Bromo-1-(3,4-difluorophenyl)ethan-1-one40706-98-764 % similar
2-Chloro-4′-fluoroacetophenone456-04-259 % similar
2-Chloro-1-(3,4-dichlorophenyl)ethanone42981-08-856 % similar
3,4-Difluorobenzoyl chloride76903-88-355 % similar
2-Chloro-3′,4′-dihydroxyacetophenone99-40-154 % similar
2,4′-Dichloroacetophenone937-20-252 % similar
2,3'-Dichloroacetophenone21886-56-651 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.
Same formula
2'-Chloro-4',5'-difluoroacetophenone121872-94-4
3'-Chloro-2',6'-difluoroacetophenone177942-50-6
2,3-Difluoro-4-methylbenzoyl chloride261763-38-6
2,6-Difluoro-3-methylbenzoyl chloride261763-39-7
2-Chloro-2,2-difluoroacetophenone384-67-8
2-Chloro-1-(2,4-difluorophenyl)ethanone51336-94-8
2-Chloro-2',5'-difluoroacetophenone60468-36-2
4'-Chloro-2',5'-difluoroacetophenone655-12-9