Cas no 2280-26-4 (L-Alanine,3-(propyldithio)-)
L-Alanine,3-(propyldithio)- structure
Product Name:L-Alanine,3-(propyldithio)-
CAS No:2280-26-4
MF:C6H13NO2S2
MW:195.302919149399
CID:284325
PubChem ID:192762
Update Time:2025-04-19
L-Alanine,3-(propyldithio)- Chemical and Physical Properties
Names and Identifiers
-
- L-Alanine,3-(propyldithio)-
- s-propylmercapto-l-cysteine
- DTXSID40945481
- JVVXIPKJTDVPQZ-YFKPBYRVSA-N
- L-Alanine, 3-(propyldithio)-
- S-Propylmercaptocysteine
- 2280-26-4
- S-Propylthio-L-cysteine
- SCHEMBL5003610
- 3-(Propyldisulfanyl)alanine
- 3-(Propyldisulfanyl)alanine #
-
- Inchi： 1S/C6H13NO2S2/c1-2-3-10-11-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
- InChI Key： JVVXIPKJTDVPQZ-YFKPBYRVSA-N
- SMILES： S(C[C@@H](C(=O)O)N)SCCC
Computed Properties
- Exact Mass: 195.03889
- Monoisotopic Mass: 195.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 121
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.8
- Topological Polar Surface Area: 114?2
Experimental Properties
- Density: 1.266
- Boiling Point: 325.8°C at 760 mmHg
- Flash Point: 150.8°C
- Refractive Index: 1.574
- PSA: 63.32
L-Alanine,3-(propyldithio)- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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