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98586-21-1 | 3,3'-Difluorobenzhydrol
CAS No: 98586-21-1 Catalog No: AG01F08N MDL No:MFCD03077396
Product Description
Catalog Number:
AG01F08N
Chemical Name:
3,3'-Difluorobenzhydrol
CAS Number:
98586-21-1
Molecular Formula:
C13H10F2O
Molecular Weight:
220.2147
MDL Number:
MFCD03077396
IUPAC Name:
bis(3-fluorophenyl)methanol
InChI:
InChI=1S/C13H10F2O/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8,13,16H
InChI Key:
JCMJXDJOHQCPOO-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(c1cccc(c1)F)O
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.07g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.219g/mol
Monoisotopic Mass:
220.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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