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346-06-5 | (2-(Trifluoromethyl)phenyl)methanol
CAS No: 346-06-5 Catalog No: AG003F5N MDL No:MFCD00004621
Product Description
Catalog Number:
AG003F5N
Chemical Name:
(2-(Trifluoromethyl)phenyl)methanol
CAS Number:
346-06-5
Molecular Formula:
C8H7F3O
Molecular Weight:
176.1358
MDL Number:
MFCD00004621
IUPAC Name:
[2-(trifluoromethyl)phenyl]methanol
InChI:
InChI=1S/C8H7F3O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4,12H,5H2
InChI Key:
TWQNSHZTQSLJEE-UHFFFAOYSA-N
SMILES:
OCc1ccccc1C(F)(F)F
EC Number:
206-467-9
Properties
Complexity:
144
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:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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