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Home > Fluorides > 1380202-32-3
1380202-32-3 | Benzeneethanol, β,β,2-trifluoro-
CAS No: 1380202-32-3 Catalog No: AG0017U6 MDL No:MFCD28038850
Product Description
Catalog Number:
AG0017U6
Chemical Name:
Benzeneethanol, β,β,2-trifluoro-
CAS Number:
1380202-32-3
Molecular Formula:
C8H7F3O
Molecular Weight:
176.1358
MDL Number:
MFCD28038850
IUPAC Name:
2,2-difluoro-2-(2-fluorophenyl)ethanol
InChI:
InChI=1S/C8H7F3O/c9-7-4-2-1-3-6(7)8(10,11)5-12/h1-4,12H,5H2
InChI Key:
XPWFTORDCSZNQQ-UHFFFAOYSA-N
SMILES:
OCC(c1ccccc1F)(F)F
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.045g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.138g/mol
Monoisotopic Mass:
176.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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