Cas no 100477-88-1 (2-Propenamide,N-(2-hydroxyethyl)-3-(methylthio)-, (2E)-)
100477-88-1 structure
Product Name:2-Propenamide,N-(2-hydroxyethyl)-3-(methylthio)-, (2E)-
CAS No:100477-88-1
MF:C6H11NO2S
MW:161.22204041481
CID:168669
PubChem ID:6439215
Update Time:2024-11-04
2-Propenamide,N-(2-hydroxyethyl)-3-(methylthio)-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenamide,N-(2-hydroxyethyl)-3-(methylthio)-, (2E)-
- (E)-N-(2-hydroxyethyl)-3-methylsulfanylprop-2-enamide
- entadamide A
- 2-Propenamide, n-(2-hydroxyethyl)-3-(methylthio)-, (E)-
- AC1O5R7Z
- C20204
- N-(2-Hydroxyethyl)-3-methylthiopropenamide
- CHEMBL2235398
- SCHEMBL18297867
- ENTADAMIDE
- 100477-88-1
- C6H11NO2S
- SCHEMBL18297864
- AKOS040736470
- E88912
- HY-N12125
- CS-0891962
- CHEBI:179370
- FS-7332
- (E)-N-(2-hydroxyethyl)-3-methylsulanylprop-2-enamide
- DA-73126
-
- Inchi： 1S/C6H11NO2S/c1-10-5-2-6(9)7-3-4-8/h2,5,8H,3-4H2,1H3,(H,7,9)/b5-2+
- InChI Key： NBRCIHAGNJRRRI-GORDUTHDSA-N
- SMILES： S(C)/C=C/C(NCCO)=O
Computed Properties
- Exact Mass: 161.05113
- Monoisotopic Mass: 161.051049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 125
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 74.6
- XLogP3: -0.4
Experimental Properties
- Density: 1.163
- Boiling Point: 379.7°Cat760mmHg
- Flash Point: 183.4°C
- Refractive Index: 1.533
- PSA: 49.33
- LogP: 0.36250
2-Propenamide,N-(2-hydroxyethyl)-3-(methylthio)-, (2E)- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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4. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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