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Home > Fluorides > 178820-39-8
178820-39-8 | 4-Hydroxy-3',4',5'-trifluorobiphenyl
CAS No: 178820-39-8 Catalog No: AG01FDN6 MDL No:
Product Description
Catalog Number:
AG01FDN6
Chemical Name:
4-Hydroxy-3',4',5'-trifluorobiphenyl
CAS Number:
178820-39-8
Molecular Formula:
C12H7F3O
Molecular Weight:
224.1786
IUPAC Name:
4-(3,4,5-trifluorophenyl)phenol
InChI:
InChI=1S/C12H7F3O/c13-10-5-8(6-11(14)12(10)15)7-1-3-9(16)4-2-7/h1-6,16H
InChI Key:
IAXMOTRFVPINOJ-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1cc(F)c(c(c1)F)F
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.045g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.182g/mol
Monoisotopic Mass:
224.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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