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247584-10-7 | 1H-Pyrazole-5-carboxamide, 4-amino-1-methyl-3-propyl-, hydrochloride (1:1)
CAS No: 247584-10-7 Catalog No: AG002PCF MDL No:MFCD11040573
Product Description
Catalog Number:
AG002PCF
Chemical Name:
1H-Pyrazole-5-carboxamide, 4-amino-1-methyl-3-propyl-, hydrochloride (1:1)
CAS Number:
247584-10-7
Molecular Formula:
C8H15ClN4O
Molecular Weight:
218.6839
MDL Number:
MFCD11040573
IUPAC Name:
4-amino-2-methyl-5-propylpyrazole-3-carboxamide;hydrochloride
InChI:
InChI=1S/C8H14N4O.ClH/c1-3-4-5-6(9)7(8(10)13)12(2)11-5;/h3-4,9H2,1-2H3,(H2,10,13);1H
InChI Key:
TWAOVUDRQJPVDF-UHFFFAOYSA-N
SMILES:
CCCc1nn(c(c1N)C(=O)N)C.Cl
EC Number:
607-432-4
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.093g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
218.685g/mol
Monoisotopic Mass:
218.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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