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1017793-12-2 | 1H-Indazole-4-carboxylic acid, 1-acetyl-
CAS No: 1017793-12-2 Catalog No: AG0005KK MDL No:
Product Description
Catalog Number:
AG0005KK
Chemical Name:
1H-Indazole-4-carboxylic acid, 1-acetyl-
CAS Number:
1017793-12-2
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
IUPAC Name:
1-acetylindazole-4-carboxylic acid
InChI:
InChI=1S/C10H8N2O3/c1-6(13)12-9-4-2-3-7(10(14)15)8(9)5-11-12/h2-5H,1H3,(H,14,15)
InChI Key:
XIXHKHXKLUNDIK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1cnn2C(=O)C
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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