Home Carboxys 4-Formyl-1H-indazole-3-carboxylic acid

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

CAS No.:
885519-90-4
Catalog Number:
AG0036AU
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
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Product Description
Catalog Number:
AG0036AU
Chemical Name:
4-Formyl-1H-indazole-3-carboxylic acid
CAS Number:
885519-90-4
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD07781433
IUPAC Name:
4-formyl-1H-indazole-3-carboxylic acid
InChI:
InChI=1S/C9H6N2O3/c12-4-5-2-1-3-6-7(5)8(9(13)14)11-10-6/h1-4H,(H,10,11)(H,13,14)
InChI Key:
CAXPLHNPOMKHLU-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1c(n[nH]2)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