Cas no 236406-65-8 (Carbamic acid,[(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI))
236406-65-8 structure
Product Name:Carbamic acid,[(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI)
CAS No:236406-65-8
MF:C11H20N2O2
MW:212.288702964783
CID:245458
Update Time:2024-01-26
Carbamic acid,[(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
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- Carbamic acid,[(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI)
- Carbamic acid, [(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester
- Carbamic acid, [(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI)
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- Inchi: 1S/C11H20N2O2/c1-11(2,3)15-10(14)13-8-9-4-6-12-7-5-9/h4,12H,5-8H2,1-3H3,(H,13,14)
- InChI Key: BGEOHCNXIILQQR-UHFFFAOYSA-N
- SMILES: C(OC(C)(C)C)(=O)NCC1=CCNCC1
Computed Properties
- Exact Mass: 212.152
- Monoisotopic Mass: 212.152
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 254
- 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
- Topological Polar Surface Area: 50.4A^2
Carbamic acid,[(1,2,3,6-tetrahydro-4-pyridinyl)methyl]-, 1,1-dimethylethyl ester (9CI) Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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