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Home > Aldehydes > 208111-07-3
208111-07-3 | 2-Pyridinecarboxaldehyde, 6-(1H-imidazol-2-yl)-
CAS No: 208111-07-3 Catalog No: AG002JIH MDL No:MFCD18262123
Product Description
Catalog Number:
AG002JIH
Chemical Name:
2-Pyridinecarboxaldehyde, 6-(1H-imidazol-2-yl)-
CAS Number:
208111-07-3
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
MDL Number:
MFCD18262123
IUPAC Name:
6-(1H-imidazol-2-yl)pyridine-2-carbaldehyde
InChI:
InChI=1S/C9H7N3O/c13-6-7-2-1-3-8(12-7)9-10-4-5-11-9/h1-6H,(H,10,11)
InChI Key:
WAUVMVGCIACKNP-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(n1)c1ncc[nH]1
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
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