Home Carboxys 2-Methylindazole-4-carboxylic acid

2-Methylindazole-4-carboxylic acid

CAS No.:
1071433-06-1
Catalog Number:
AG008U78
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
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Product Description
Catalog Number:
AG008U78
Chemical Name:
2-Methylindazole-4-carboxylic acid
CAS Number:
1071433-06-1
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD15071443
IUPAC Name:
2-methylindazole-4-carboxylic acid
InChI:
InChI=1S/C9H8N2O2/c1-11-5-7-6(9(12)13)3-2-4-8(7)10-11/h2-5H,1H3,(H,12,13)
InChI Key:
DPLXRRMSJKKHDU-UHFFFAOYSA-N
SMILES:
Cn1nc2c(c1)c(ccc2)C(=O)O
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties