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164223-42-1 | Isoxazolo[4,5-c]pyridin-4(5H)-one, 6,7-dihydro-3-methyl-
CAS No: 164223-42-1 Catalog No: AG001UQ2 MDL No:
Product Description
Catalog Number:
AG001UQ2
Chemical Name:
Isoxazolo[4,5-c]pyridin-4(5H)-one, 6,7-dihydro-3-methyl-
CAS Number:
164223-42-1
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
IUPAC Name:
3-methyl-6,7-dihydro-5H-[1,2]oxazolo[4,5-c]pyridin-4-one
InChI:
InChI=1S/C7H8N2O2/c1-4-6-5(11-9-4)2-3-8-7(6)10/h2-3H2,1H3,(H,8,10)
InChI Key:
FYWWPWWCVAKGEY-UHFFFAOYSA-N
SMILES:
O=C1NCCc2c1c(C)no2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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