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548777-17-9 | 1H-Imidazole-4-carboxamide,N-2-propynyl-(9CI)
CAS No: 548777-17-9 Catalog No: AG00DX8T MDL No:
Product Description
Catalog Number:
AG00DX8T
Chemical Name:
1H-Imidazole-4-carboxamide,N-2-propynyl-(9CI)
CAS Number:
548777-17-9
IUPAC Name:
N-prop-2-ynyl-1H-imidazole-5-carboxamide
InChI:
InChI=1S/C7H7N3O/c1-2-3-9-7(11)6-4-8-5-10-6/h1,4-5H,3H2,(H,8,10)(H,9,11)
InChI Key:
JXBHMTXWBOSYQR-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.153g/mol
Monoisotopic Mass:
149.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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