Home Halogens 2-chloro-4-(1-propyl-1H-imidazole-2-carbonyl)pyridine

2-chloro-4-(1-propyl-1H-imidazole-2-carbonyl)pyridine

CAS No.:
1513545-37-3
Catalog Number:
AG01AM0K
Molecular Formula:
C12H12ClN3O
Molecular Weight:
249.6962
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Product Description
Catalog Number:
AG01AM0K
Chemical Name:
2-chloro-4-(1-propyl-1H-imidazole-2-carbonyl)pyridine
CAS Number:
1513545-37-3
Molecular Formula:
C12H12ClN3O
Molecular Weight:
249.6962
MDL Number:
MFCD24978273
IUPAC Name:
(2-chloropyridin-4-yl)-(1-propylimidazol-2-yl)methanone
InChI:
InChI=1S/C12H12ClN3O/c1-2-6-16-7-5-15-12(16)11(17)9-3-4-14-10(13)8-9/h3-5,7-8H,2,6H2,1H3
InChI Key:
SQFVPHHISBZPDO-UHFFFAOYSA-N
SMILES:
CCCn1ccnc1C(=O)c1ccnc(c1)Cl
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.067g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.698g/mol
Monoisotopic Mass:
249.067g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties