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Home > Imidazoles > 117668-37-8
117668-37-8 | 3-Pyridinecarbonylchloride, 6-(1H-imidazol-2-yl)-
CAS No: 117668-37-8 Catalog No: AG0081GD MDL No:
Product Description
Catalog Number:
AG0081GD
Chemical Name:
3-Pyridinecarbonylchloride, 6-(1H-imidazol-2-yl)-
CAS Number:
117668-37-8
Molecular Formula:
C9H6ClN3O
Molecular Weight:
207.6164
IUPAC Name:
6-(1H-imidazol-2-yl)pyridine-3-carbonyl chloride
InChI:
InChI=1S/C9H6ClN3O/c10-8(14)6-1-2-7(13-5-6)9-11-3-4-12-9/h1-5H,(H,11,12)
InChI Key:
GMZKAFPCDDFSED-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(nc1)c1ncc[nH]1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.617g/mol
Monoisotopic Mass:
207.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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