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21466-00-2 | 1H-Pyrazole-4-carboxamide, 3-(3,3-dimethyl-1-triazen-1-yl)-
CAS No: 21466-00-2 Catalog No: AG002P93 MDL No:
Product Description
Catalog Number:
AG002P93
Chemical Name:
1H-Pyrazole-4-carboxamide, 3-(3,3-dimethyl-1-triazen-1-yl)-
CAS Number:
21466-00-2
Molecular Formula:
C6H10N6O
Molecular Weight:
182.1832
IUPAC Name:
5-(dimethylaminodiazenyl)-1H-pyrazole-4-carboxamide
InChI:
InChI=1S/C6H10N6O/c1-12(2)11-10-6-4(5(7)13)3-8-9-6/h3H,1-2H3,(H2,7,13)(H,8,9)
InChI Key:
XVZVNGZABZHDKO-UHFFFAOYSA-N
SMILES:
CN(N=Nc1n[nH]cc1C(=O)N)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.092g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.187g/mol
Monoisotopic Mass:
182.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.1
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