Cas no 17891-06-4 (Methyl 6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate)
17891-06-4 structure
Product Name:Methyl 6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
CAS No:17891-06-4
MF:C11H13NO3
MW:207.225823163986
CID:1084043
PubChem ID:10976661
Update Time:2025-04-20
Methyl 6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate Chemical and Physical Properties
Names and Identifiers
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- Methyl 6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
- 4-OXO-6,7,8,9-TETRAHYDRO-4H-QUINOLIZINE-1-CARBOXYLIC ACID METHYL ESTER
- methyl 4-oxo-6,7,8,9-tetrahydroquinolizine-1-carboxylate
- Methyl 6-oxo-1,3,4,6-tetrahydro-2H-quinolizine-9-carboxylate
- DTXSID10450456
- 2H-Quinolizine-9-carboxylic acid, 1,3,4,6-tetrahydro-6-oxo-, methyl ester
- 17891-06-4
-
- Inchi： 1S/C11H13NO3/c1-15-11(14)8-5-6-10(13)12-7-3-2-4-9(8)12/h5-6H,2-4,7H2,1H3
- InChI Key： QRGWYGYVCJSIKS-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C(=O)OC)=C2CCCCN21
Computed Properties
- Exact Mass: 207.08954328g/mol
- Monoisotopic Mass: 207.08954328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 368
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 46.6?2
Methyl 6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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