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Home > Fluorides > 126485-55-0
126485-55-0 | [1,1'-Biphenyl]-3-methanol, 4'-(trifluoromethyl)-
CAS No: 126485-55-0 Catalog No: AG000SUR MDL No:MFCD06203007
Product Description
Catalog Number:
AG000SUR
Chemical Name:
[1,1'-Biphenyl]-3-methanol, 4'-(trifluoromethyl)-
CAS Number:
126485-55-0
Molecular Formula:
C14H11F3O
Molecular Weight:
252.2317
MDL Number:
MFCD06203007
IUPAC Name:
[3-[4-(trifluoromethyl)phenyl]phenyl]methanol
InChI:
InChI=1S/C14H11F3O/c15-14(16,17)13-6-4-11(5-7-13)12-3-1-2-10(8-12)9-18/h1-8,18H,9H2
InChI Key:
BKESULFFLXBNLC-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.076g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.236g/mol
Monoisotopic Mass:
252.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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