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787615-24-1

787615-24-1 structural image
Product Name: 3-(4-TRIFLUOROMETHYLPHENYL)-DL-BETA-ALANINOL
Formula: C10H12F3NO
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H319:Serious eye damage/eye irritation
Precautionary Statement Codes P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 219.20 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 219.08709849 g/mol
Monoisotopic Mass 219.08709849 g/mol
Topological Polar Surface Area 46.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 188
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