2-(Trifluoromethyl)phenacyl bromide

C9H6BrF3OCAS 54109-16-9267.05 g/mol

OBrFFF
Alkyl halideKetone

Properties

Molecular formula
C9H6BrF3O
Molar mass
267.05 g/mol
Exact mass
265.9554 Da
logP
3.28Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P234, P260, P261, P264, P264+P265, P270, P271, P280, 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, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, P501

Identifiers

CAS number
54109-16-9
SMILES
C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F
InChIKey
KWZCBMKXNYOQAK-UHFFFAOYSA-N
InChI
InChI=1S/C9H6BrF3O/c10-5-8(14)6-3-1-2-4-7(6)9(11,12)13/h1-4H,5H2

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

Names and synonyms

1 names
  • 2-Bromo-1-[2-(trifluoromethyl)phenyl]ethan-1-one

Work with 2-(Trifluoromethyl)phenacyl bromide

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere