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Home > Imidazoles > 91736-11-7
91736-11-7 | N-PROPYL-1H-IMIDAZOLE-4-CARBOXAMIDE
CAS No: 91736-11-7 Catalog No: AG006E3S MDL No:
Product Description
Catalog Number:
AG006E3S
Chemical Name:
N-PROPYL-1H-IMIDAZOLE-4-CARBOXAMIDE
CAS Number:
91736-11-7
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
IUPAC Name:
N-propyl-1H-imidazole-5-carboxamide
InChI:
InChI=1S/C7H11N3O/c1-2-3-9-7(11)6-4-8-5-10-6/h4-5H,2-3H2,1H3,(H,8,10)(H,9,11)
InChI Key:
JGQMXDQYGAMVJP-UHFFFAOYSA-N
SMILES:
CCCNC(=O)c1c[nH]cn1
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
153.185g/mol
Monoisotopic Mass:
153.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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