Cas no 62404-81-3 (L-Cysteine, N-(2-mercapto-1-oxopropyl)-)
62404-81-3 structure
Product Name:L-Cysteine, N-(2-mercapto-1-oxopropyl)-
CAS No:62404-81-3
MF:C6H11NO3S2
MW:209.286439180374
CID:445890
PubChem ID:21152492
Update Time:2025-04-19
L-Cysteine, N-(2-mercapto-1-oxopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- L-Cysteine, N-(2-mercapto-1-oxopropyl)-
- (2R)-3-sulfanyl-2-(2-sulfanylpropanoylamino)propanoic acid
- DTXSID60611090
- 62404-81-3
- N-(2-Sulfanylpropanoyl)-L-cysteine
- SCHEMBL525145
- CHEMBL309914
- BDBM50406932
-
- Inchi： 1S/C6H11NO3S2/c1-3(12)5(8)7-4(2-11)6(9)10/h3-4,11-12H,2H2,1H3,(H,7,8)(H,9,10)/t3?,4-/m0/s1
- InChI Key： ODOSCUPDIXDNHR-BKLSDQPFSA-N
- SMILES： SC(C)C(N[C@H](C(=O)O)CS)=O
Computed Properties
- Exact Mass: 209.01813
- Monoisotopic Mass: 209.01803556g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 186
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.2
- Topological Polar Surface Area: 68.4?2
Experimental Properties
- PSA: 66.4
L-Cysteine, N-(2-mercapto-1-oxopropyl)- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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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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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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