Cas no 38206-86-9 (1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester)
![1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester structure](https://ossimg.kuujia.com/scimg/38500/38206-86-9x500.png)
38206-86-9 structure
Product Name:1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester
CAS No:38206-86-9
MF:C9H15NO2
MW:169.220902681351
CID:1111785
PubChem ID:2736953
Update Time:2025-04-20
1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester
- methyl 1-azabicyclo[2.2.2]octane-3-carboxylate
- methylquinuclidine-3-carboxylate
- CHEMBL14648
- DTXSID60371728
- NoName_3182
- BDBM50212556
- 38206-86-9
- SCHEMBL6965129
- 3-carbomethoxy-1-azabicyclo[2.2.2]octane
- (+/-) Methyl 1-azabicyclo[2.2.2]octane-3-carboxylate
- AKOS006228866
- RSOWDTALVBLZPE-UHFFFAOYSA-N
- DTXSID70902643
- quinuclidine-3-carboxylic acid methyl ester
- METHYL QUINUCLIDINE-3-CARBOXYLATE
- methyl 3-quinuclidine carboxylate
- quinuclidine, 3-methoxycarbonyl-
-
- Inchi： 1S/C9H15NO2/c1-12-9(11)8-6-10-4-2-7(8)3-5-10/h7-8H,2-6H2,1H3
- InChI Key： RSOWDTALVBLZPE-UHFFFAOYSA-N
- SMILES： O(C)C(C1CN2CCC1CC2)=O
Computed Properties
- Exact Mass: 169.11035
- Monoisotopic Mass: 169.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
38206-86-9 (1-Azabicyclo[2.2.2]octane-3-carboxylic acid, methyl ester) Related Products
- 1690-75-1(methyl 1-methylpiperidine-4-carboxylate)
- 25137-01-3(ethyl (3R)-piperidine-3-carboxylate)
- 37675-18-6(Ethyl (3S)-piperidine-3-carboxylate)
- 71962-74-8(Ethyl nipecotate)
- 5166-67-6(Ethyl 1-Methylpiperidine-3-carboxylate)
- 170843-43-3(Ethyl 3-methylpiperidine-3-carboxylate)
- 50585-89-2(Methyl piperidine-3-carboxylate)
- 1690-72-8(Methyl 1-methylpiperidine-3-carboxylate)
- 5006-62-2(Ethyl piperidine-3-carboxylate)
- 164323-85-7(methyl (3R)-piperidine-3-carboxylate)
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