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Home > Fluorides > 207291-85-8
207291-85-8 | Phenol, 2-fluoro-3-(trifluoromethyl)-
CAS No: 207291-85-8 Catalog No: AG002IXG MDL No:MFCD00083554
Product Description
Catalog Number:
AG002IXG
Chemical Name:
Phenol, 2-fluoro-3-(trifluoromethyl)-
CAS Number:
207291-85-8
Molecular Formula:
C7H4F4O
Molecular Weight:
180.0997
MDL Number:
MFCD00083554
IUPAC Name:
2-fluoro-3-(trifluoromethyl)phenol
InChI:
InChI=1S/C7H4F4O/c8-6-4(7(9,10)11)2-1-3-5(6)12/h1-3,12H
InChI Key:
DOICLFHNNMXINV-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1F)C(F)(F)F
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.102g/mol
Monoisotopic Mass:
180.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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