Home Carboxys 3-Formyl-1H-indazole-5-carboxylic acid

3-Formyl-1H-indazole-5-carboxylic acid

CAS No.:
885519-98-2
Catalog Number:
AG004F4G
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
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Product Description
Catalog Number:
AG004F4G
Chemical Name:
3-Formyl-1H-indazole-5-carboxylic acid
CAS Number:
885519-98-2
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD06656900
IUPAC Name:
3-formyl-2H-indazole-5-carboxylic acid
InChI:
InChI=1S/C9H6N2O3/c12-4-8-6-3-5(9(13)14)1-2-7(6)10-11-8/h1-4H,(H,10,11)(H,13,14)
InChI Key:
MAPWHWRNFRJKFI-UHFFFAOYSA-N
SMILES:
O=Cc1n[nH]c2c1cc(cc2)C(=O)O
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties