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844683-65-4 | 3,3',4-Trifluorobenzhydrol
CAS No: 844683-65-4 Catalog No: AG01EXOS MDL No:MFCD06201321
Product Description
Catalog Number:
AG01EXOS
Chemical Name:
3,3',4-Trifluorobenzhydrol
CAS Number:
844683-65-4
Molecular Formula:
C13H9F3O
Molecular Weight:
238.2052
MDL Number:
MFCD06201321
IUPAC Name:
(3,4-difluorophenyl)-(3-fluorophenyl)methanol
InChI:
InChI=1S/C13H9F3O/c14-10-3-1-2-8(6-10)13(17)9-4-5-11(15)12(16)7-9/h1-7,13,17H
InChI Key:
BNJQWECBHNESTE-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(c1ccc(c(c1)F)F)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.061g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.209g/mol
Monoisotopic Mass:
238.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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