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99727-20-5

99727-20-5 structural image
Product Name: 1,1,1-TRIFLUORO-2-PHENYL-3-BUTYN-2-OL
Formula: C10H7F3O
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P403+P235:Store in a well-ventilated place. Keep cool.

COMPUTED DESCRIPTORS

Molecular Weight 200.16 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 200.04489933 g/mol
Monoisotopic Mass 200.04489933 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 244
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