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89391-16-2 | 3H-Oxazolo[3,4-a]pyridine-1,3(5H)-dione, tetrahydro-8a-methyl-
CAS No: 89391-16-2 Catalog No: AG003WB8 MDL No:
Product Description
Catalog Number:
AG003WB8
Chemical Name:
3H-Oxazolo[3,4-a]pyridine-1,3(5H)-dione, tetrahydro-8a-methyl-
CAS Number:
89391-16-2
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
IUPAC Name:
8a-methyl-5,6,7,8-tetrahydro-[1,3]oxazolo[3,4-a]pyridine-1,3-dione
InChI:
InChI=1S/C8H11NO3/c1-8-4-2-3-5-9(8)7(11)12-6(8)10/h2-5H2,1H3
InChI Key:
OJCHJCLJZXKHMA-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2(N1CCCC2)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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