Home Carboxys 2-methyl-4,5,6,7-tetrahydro-2H-indazole-4-carboxylic acid

2-methyl-4,5,6,7-tetrahydro-2H-indazole-4-carboxylic acid

CAS No.:
1557768-83-8
Catalog Number:
AG01BHCF
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
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Product Description
Catalog Number:
AG01BHCF
Chemical Name:
2-methyl-4,5,6,7-tetrahydro-2H-indazole-4-carboxylic acid
CAS Number:
1557768-83-8
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
MDL Number:
MFCD28246257
IUPAC Name:
2-methyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
InChI:
InChI=1S/C9H12N2O2/c1-11-5-7-6(9(12)13)3-2-4-8(7)10-11/h5-6H,2-4H2,1H3,(H,12,13)
InChI Key:
YAWPIGWXURCZPH-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCc2c1cn(n2)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.207g/mol
Monoisotopic Mass:
180.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties