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87286-02-0 | METHYL 5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE-8-CARBOXYLATE
CAS No: 87286-02-0 Catalog No: AG004HZ3 MDL No:
Product Description
Catalog Number:
AG004HZ3
Chemical Name:
METHYL 5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE-8-CARBOXYLATE
CAS Number:
87286-02-0
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
IUPAC Name:
methyl 5-oxo-2,3-dihydro-1H-indolizine-8-carboxylate
InChI:
InChI=1S/C10H11NO3/c1-14-10(13)7-4-5-9(12)11-6-2-3-8(7)11/h4-5H,2-3,6H2,1H3
InChI Key:
OHDXOCXOFHYAAT-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(=O)n2c1CCC2
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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