Cas no 2196-58-9 (Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]-)
![Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]- structure](https://ossimg.kuujia.com/scimg/2500/2196-58-9x500.png)
2196-58-9 structure
Product Name:Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]-
CAS No:2196-58-9
MF:C7H14N2O4Se
MW:269.157061100006
CID:266981
PubChem ID:98223
Update Time:2025-04-19
Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]-
- 2196-58-9
- CHEBI:26630
- 2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butyric acid
- NSC90812
- DTXSID60944557
- NSC-90812
- Q27103094
- 2-amino-4-(2-amino-3-hydroxy-3-oxopropyl)selanylbutanoic acid
- selenocystathionines
- 2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butanoic acid
- Selenocystathionine
-
- Inchi： 1S/C7H14N2O4Se/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
- InChI Key： ZNWYDQPOUQRDLY-UHFFFAOYSA-N
- SMILES： [Se](CC(C(=O)O)N)CCC(C(=O)O)N
Computed Properties
- Exact Mass: 264.01792
- Monoisotopic Mass: 270.012
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 212
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 127?2
- XLogP3: -3.464
Experimental Properties
- Boiling Point: 489.4°Cat760mmHg
- Flash Point: 249.8°C
- PSA: 126.64
Butanoic acid,2-amino-4-[(2-amino-2-carboxyethyl)seleno]- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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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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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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