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780800-85-3

780800-85-3 | 2-Pyridinecarboxaldehyde,5-phenyl-

CAS No: 780800-85-3 Catalog No: AG008NQ6 MDL No:MFCD10700050

Product Description

Catalog Number:
AG008NQ6
Chemical Name:
2-Pyridinecarboxaldehyde,5-phenyl-
CAS Number:
780800-85-3
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD10700050
IUPAC Name:
5-phenylpyridine-2-carbaldehyde
InChI:
InChI=1S/C12H9NO/c14-9-12-7-6-11(8-13-12)10-4-2-1-3-5-10/h1-9H
InChI Key:
IMMPVOLAPKOFFB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cn1)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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