Home Carboxys 4-Amino-1-methyl-1H-pyrazole-3-carboxylic acid hydrochloride

4-Amino-1-methyl-1H-pyrazole-3-carboxylic acid hydrochloride

CAS No.:
1189693-96-6
Catalog Number:
AG0092IC
Molecular Formula:
C5H8ClN3O2
Molecular Weight:
177.5889
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Product Description
Catalog Number:
AG0092IC
Chemical Name:
4-Amino-1-methyl-1H-pyrazole-3-carboxylic acid hydrochloride
CAS Number:
1189693-96-6
Molecular Formula:
C5H8ClN3O2
Molecular Weight:
177.5889
MDL Number:
MFCD04967242
IUPAC Name:
4-amino-1-methylpyrazole-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C5H7N3O2.ClH/c1-8-2-3(6)4(7-8)5(9)10;/h2H,6H2,1H3,(H,9,10);1H
InChI Key:
QXKPVAWGIISQML-UHFFFAOYSA-N
SMILES:
Cn1cc(c(n1)C(=O)O)N.Cl
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
177.588g/mol
Monoisotopic Mass:
177.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties