Home Carboxys 5-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylic acid hydrochloride

5-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylic acid hydrochloride

CAS No.:
1797274-41-9
Catalog Number:
AG01ACX0
Molecular Formula:
C6H10ClN3O2
Molecular Weight:
191.6155
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Product Description
Catalog Number:
AG01ACX0
Chemical Name:
5-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylic acid hydrochloride
CAS Number:
1797274-41-9
Molecular Formula:
C6H10ClN3O2
Molecular Weight:
191.6155
MDL Number:
MFCD26936166
IUPAC Name:
5-(aminomethyl)-1-methylpyrazole-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H9N3O2.ClH/c1-9-5(2-7)4(3-8-9)6(10)11;/h3H,2,7H2,1H3,(H,10,11);1H
InChI Key:
FYOPCMJIIRXSJC-UHFFFAOYSA-N
SMILES:
NCc1n(C)ncc1C(=O)O.Cl
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.046g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
191.615g/mol
Monoisotopic Mass:
191.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties