2-Nitro-5-(trifluoromethoxy)benzyl bromide

HCID 66716591
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Basic information

Standard SMILES
O=[N+]([O-])c1ccc(OC(F)(F)F)cc1CBr
InChIKey
WVEQOTDSEYBKTM-UHFFFAOYSA-N
Molecular formula
C8H5BrF3NO3
Average molar mass
300.03 g/mol
Monoisotopic mass
298.94049

Names & identifiers

Preferred name
2-Nitro-5-(trifluoromethoxy)benzyl bromide
IUPAC
2-(bromomethyl)-1-nitro-4-(trifluoromethoxy)benzene

Names & synonyms

875548-93-92-Nitro-5-(trifluoromethoxy)benzyl bromideBenzene, 2-(bromomethyl)-1-nitro-4-(trifluoromethoxy)-SCHEMBL531362DB-0933372-(bromomethyl)-1-nitro-4-(trifluoromethoxy)benzene

Database identifiers

PubChem CID
66716591

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
55.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
16

Related reactions

8 records
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Compound notes

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