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946840-70-6 | 6-amino-5-methyl-2H-indazole-7-carboxylic acid
CAS No: 946840-70-6 Catalog No: AG01FIEE MDL No:
Product Description
Catalog Number:
AG01FIEE
Chemical Name:
6-amino-5-methyl-2H-indazole-7-carboxylic acid
CAS Number:
946840-70-6
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
IUPAC Name:
6-amino-5-methyl-1H-indazole-7-carboxylic acid
InChI:
InChI=1S/C9H9N3O2/c1-4-2-5-3-11-12-8(5)6(7(4)10)9(13)14/h2-3H,10H2,1H3,(H,11,12)(H,13,14)
InChI Key:
SAWNFCCPPRARBZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(N)c(C)cc2c1n[nH]c2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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