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88059-51-2 | Benzamide, N-(1,5-dimethyl-1H-pyrazol-3-yl)-2-hydroxy-
CAS No: 88059-51-2 Catalog No: AG004IEF MDL No:
Product Description
Catalog Number:
AG004IEF
Chemical Name:
Benzamide, N-(1,5-dimethyl-1H-pyrazol-3-yl)-2-hydroxy-
CAS Number:
88059-51-2
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
IUPAC Name:
N-(1,5-dimethylpyrazol-3-yl)-2-hydroxybenzamide
InChI:
InChI=1S/C12H13N3O2/c1-8-7-11(14-15(8)2)13-12(17)9-5-3-4-6-10(9)16/h3-7,16H,1-2H3,(H,13,14,17)
InChI Key:
OTGLBAQXGJSHTJ-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1O)Nc1nn(c(c1)C)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.255g/mol
Monoisotopic Mass:
231.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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