Cas no 210767-27-4 (Carbamic acid,[2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester (9CI))
210767-27-4 structure
Product Name:Carbamic acid,[2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester (9CI)
CAS No:210767-27-4
MF:C9H20N2O2S
MW:220.332301139832
CID:242324
PubChem ID:11074923
Update Time:2025-04-19
Carbamic acid,[2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid,[2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester (9CI)
- tert-butyl 2-(2-aminoethylthio)ethylcarbamate
- SCHEMBL10331453
- [2-[(2-Aminoethyl)thio]ethyl]carbamic acid tert-butyl ester
- Tert-butyl N-[2-(2-aminoethylsulfanyl)ethyl]carbamate
- 210767-27-4
- AKOS027402473
- Carbamic acid, [2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester
- TERT-BUTYL N-{2-[(2-AMINOETHYL)SULFANYL]ETHYL}CARBAMATE
- FR-0014
-
- Inchi: 1S/C9H20N2O2S/c1-9(2,3)13-8(12)11-5-7-14-6-4-10/h4-7,10H2,1-3H3,(H,11,12)
- InChI Key: MYRODIPSUXCNAZ-UHFFFAOYSA-N
- SMILES: S(CCN)CCNC(=O)OC(C)(C)C
Computed Properties
- Exact Mass: 220.1247
- Monoisotopic Mass: 220.12454906g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 169
- 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: 0.6
- Topological Polar Surface Area: 89.6?2
Experimental Properties
- PSA: 64.35
Carbamic acid,[2-[(2-aminoethyl)thio]ethyl]-, 1,1-dimethylethyl ester (9CI) Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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