Cas no 27166-55-8 (Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]-)
![Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]- structure](https://ossimg.kuujia.com/scimg/27500/27166-55-8x500.png)
27166-55-8 structure
Product Name:Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]-
CAS No:27166-55-8
MF:C8H15NO3
MW:173.209602594376
CID:283223
PubChem ID:281626
Update Time:2025-04-19
Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]-
- 2-ethyl-2-(methylcarbamoyl)butanoic acid
- AC1L5UT1
- AC1Q5L9X
- AG-K-84964
- AR-1E1400
- CTK4F9199
- NSC134484
- NSC-134484
- DTXSID70300049
- 27166-55-8
-
- Inchi： 1S/C8H15NO3/c1-4-8(5-2,7(11)12)6(10)9-3/h4-5H2,1-3H3,(H,9,10)(H,11,12)
- InChI Key： CMXRCMBKCBYXMW-UHFFFAOYSA-N
- SMILES： OC(C(C(NC)=O)(CC)CC)=O
Computed Properties
- Exact Mass: 173.10525
- Monoisotopic Mass: 173.10519334g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 185
- 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: 0.9
- Topological Polar Surface Area: 66.4?2
Experimental Properties
- PSA: 66.4
- LogP: 1.01430
Butanoic acid,2-ethyl-2-[(methylamino)carbonyl]- Related Literature
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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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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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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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