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Home > Aldehydes > 113118-84-6
113118-84-6 | 3-Phenylpyridine-5-carboxaldehyde
CAS No: 113118-84-6 Catalog No: AG008XX5 MDL No:MFCD03086178
Product Description
Catalog Number:
AG008XX5
Chemical Name:
3-Phenylpyridine-5-carboxaldehyde
CAS Number:
113118-84-6
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD03086178
IUPAC Name:
5-phenylpyridine-3-carbaldehyde
InChI:
InChI=1S/C12H9NO/c14-9-10-6-12(8-13-7-10)11-4-2-1-3-5-11/h1-9H
InChI Key:
ACFVOZGSDCHVGJ-UHFFFAOYSA-N
SMILES:
O=Cc1cncc(c1)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:
1.9
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