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Home > Aldehydes > 279251-08-0
279251-08-0 | 1H-Imidazole-5-carboxaldehyde,2-(2-pyridinyl)-
CAS No: 279251-08-0 Catalog No: AG007JQ8 MDL No:
Product Description
Catalog Number:
AG007JQ8
Chemical Name:
1H-Imidazole-5-carboxaldehyde,2-(2-pyridinyl)-
CAS Number:
279251-08-0
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
IUPAC Name:
2-pyridin-2-yl-1H-imidazole-5-carbaldehyde
InChI:
InChI=1S/C9H7N3O/c13-6-7-5-11-9(12-7)8-3-1-2-4-10-8/h1-6H,(H,11,12)
InChI Key:
JYJQYZQOISNECN-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c(n1)c1ccccn1
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.175g/mol
Monoisotopic Mass:
173.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Structures and spin states of bis(tridentate)-type mononuclear and triple helicate dinuclear iron(II) complexes of imidazole-4-carbaldehyde azine. | Inorganic chemistry 20090921 |
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