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1234616-78-4 | 2H-Indazole-6-carboxylic acid, 2,3-dimethyl-
CAS No: 1234616-78-4 Catalog No: AG000KN1 MDL No:MFCD17015989
Product Description
Catalog Number:
AG000KN1
Chemical Name:
2H-Indazole-6-carboxylic acid, 2,3-dimethyl-
CAS Number:
1234616-78-4
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD17015989
IUPAC Name:
2,3-dimethylindazole-6-carboxylic acid
InChI:
InChI=1S/C10H10N2O2/c1-6-8-4-3-7(10(13)14)5-9(8)11-12(6)2/h3-5H,1-2H3,(H,13,14)
InChI Key:
LPCBXSICRRCTAU-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)nn(c2C)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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