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Home > Aldehydes > 126163-38-0
126163-38-0 | [1,1'-Biphenyl]-4-carboxaldehyde, 2',3'-difluoro-
CAS No: 126163-38-0 Catalog No: AG000RWB MDL No:
Product Description
Catalog Number:
AG000RWB
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde, 2',3'-difluoro-
CAS Number:
126163-38-0
Molecular Formula:
C13H8F2O
Molecular Weight:
218.1988
IUPAC Name:
4-(2,3-difluorophenyl)benzaldehyde
InChI:
InChI=1S/C13H8F2O/c14-12-3-1-2-11(13(12)15)10-6-4-9(8-16)5-7-10/h1-8H
InChI Key:
ZDUDMSFCYIXWBI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1cccc(c1F)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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