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89246-94-6 | Isoxazolo[5,4-b]pyridin-6(7H)-one, 7-ethyl-3,4-dimethyl-
CAS No: 89246-94-6 Catalog No: AG004266 MDL No:
Product Description
Catalog Number:
AG004266
Chemical Name:
Isoxazolo[5,4-b]pyridin-6(7H)-one, 7-ethyl-3,4-dimethyl-
CAS Number:
89246-94-6
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
IUPAC Name:
7-ethyl-3,4-dimethyl-[1,2]oxazolo[5,4-b]pyridin-6-one
InChI:
InChI=1S/C10H12N2O2/c1-4-12-8(13)5-6(2)9-7(3)11-14-10(9)12/h5H,4H2,1-3H3
InChI Key:
QNRKRSCZYYCRFW-UHFFFAOYSA-N
SMILES:
CCn1c(=O)cc(c2c1onc2C)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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