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Home > Aldehydes > 135862-45-2
135862-45-2 | 3',4'-DIFLUOROBIPHENYL-4-CARBALDEHYDE
CAS No: 135862-45-2 Catalog No: AG0072AN MDL No:
Product Description
Catalog Number:
AG0072AN
Chemical Name:
3',4'-DIFLUOROBIPHENYL-4-CARBALDEHYDE
CAS Number:
135862-45-2
Molecular Formula:
C13H8F2O
Molecular Weight:
218.1988
IUPAC Name:
4-(3,4-difluorophenyl)benzaldehyde
InChI:
InChI=1S/C13H8F2O/c14-12-6-5-11(7-13(12)15)10-3-1-9(8-16)2-4-10/h1-8H
InChI Key:
CFPZRONYLRQBAU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccc(c(c1)F)F
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.054g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.203g/mol
Monoisotopic Mass:
218.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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