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101192-30-7 | 1H-Benzo[c]quinolizine-2-carboxylic acid, 1-oxo-, ethyl ester
CAS No: 101192-30-7 Catalog No: AG0003WV MDL No:
Product Description
Catalog Number:
AG0003WV
Chemical Name:
1H-Benzo[c]quinolizine-2-carboxylic acid, 1-oxo-, ethyl ester
CAS Number:
101192-30-7
Molecular Formula:
C16H13NO3
Molecular Weight:
267.2793
IUPAC Name:
ethyl 1-oxobenzo[c]quinolizine-2-carboxylate
InChI:
InChI=1S/C16H13NO3/c1-2-20-16(19)13-10-9-12-8-7-11-5-3-4-6-14(11)17(12)15(13)18/h3-10H,2H2,1H3
InChI Key:
YISZIUALHMRHMU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2n(c1=O)c1ccccc1cc2
Properties
Complexity:
530
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.284g/mol
Monoisotopic Mass:
267.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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