Home Carboxys 1-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid hydrochloride

1-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid hydrochloride

CAS No.:
1955560-60-7
Catalog Number:
AG01C1Y9
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
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Product Description
Catalog Number:
AG01C1Y9
Chemical Name:
1-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid hydrochloride
CAS Number:
1955560-60-7
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
MDL Number:
MFCD29054901
IUPAC Name:
1-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C9H12N2O2.ClH/c1-11-7-5-3-2-4-6(7)8(10-11)9(12)13;/h2-5H2,1H3,(H,12,13);1H
InChI Key:
XGYFJVZJUHILPI-UHFFFAOYSA-N
SMILES:
OC(=O)c1nn(c2c1CCCC2)C.Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.665g/mol
Monoisotopic Mass:
216.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties