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59770-96-6

59770-96-6 structural image
Product Name: 3-(1-BROMOETHYL)BENZOTRIFLUORIDE
Formula: C9H8BrF3
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 253.06 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 251.97615 g/mol
Monoisotopic Mass 251.97615 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 167
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes