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Home > Aldehydes > 176526-00-4
176526-00-4 | Benzaldehyde, 2-(4-pyridinyl)-
CAS No: 176526-00-4 Catalog No: AG0024Q1 MDL No:MFCD02684098
Product Description
Catalog Number:
AG0024Q1
Chemical Name:
Benzaldehyde, 2-(4-pyridinyl)-
CAS Number:
176526-00-4
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD02684098
IUPAC Name:
2-pyridin-4-ylbenzaldehyde
InChI:
InChI=1S/C12H9NO/c14-9-11-3-1-2-4-12(11)10-5-7-13-8-6-10/h1-9H
InChI Key:
HPSCYFZOYJSYGZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1c1ccncc1
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
Literature
| Title | Journal |
|---|---|
| 1,2-Diphenyl-2-[4-(4-pyridyl)benzyl-idene-hydrazono]ethan-1-one. | Acta crystallographica. Section E, Structure reports online 20090801 |
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