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Home > Aldehydes > 157402-44-3
157402-44-3 | 2-Pyridinecarboxaldehyde, 6-phenyl-
CAS No: 157402-44-3 Catalog No: AG001PFN MDL No:
Product Description
Catalog Number:
AG001PFN
Chemical Name:
2-Pyridinecarboxaldehyde, 6-phenyl-
CAS Number:
157402-44-3
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
IUPAC Name:
6-phenylpyridine-2-carbaldehyde
InChI:
InChI=1S/C12H9NO/c14-9-11-7-4-8-12(13-11)10-5-2-1-3-6-10/h1-9H
InChI Key:
PVZMGWZOXQPFLS-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(n1)c1ccccc1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.21g/mol
Monoisotopic Mass:
183.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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