Cas no 656822-49-0 (L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]-)
![L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]- structure](https://ossimg.kuujia.com/scimg/657000/656822-49-0x500.png)
656822-49-0 structure
Product Name:L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]-
CAS No:656822-49-0
MF:C9H19NO3S
MW:221.317061662674
CID:397595
PubChem ID:71375485
Update Time:2025-04-19
L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]- Chemical and Physical Properties
Names and Identifiers
-
- L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]-
- DTXSID30798221
- S-[(3S)-1-Hydroxyhexan-3-yl]-L-cysteine
- 656822-49-0
-
- Inchi： 1S/C9H19NO3S/c1-2-3-7(4-5-11)14-6-8(10)9(12)13/h7-8,11H,2-6,10H2,1H3,(H,12,13)/t7-,8-/m0/s1
- InChI Key： GTJBXOQYHBJVCS-YUMQZZPRSA-N
- SMILES： S(C[C@@H](C(=O)O)N)[C@H](CCO)CCC
Computed Properties
- Exact Mass: 221.10867
- Monoisotopic Mass: 221.10856464g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 8
- Complexity: 166
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.7
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 83.55
L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]- Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
656822-49-0 (L-Cysteine, S-[(1S)-1-(2-hydroxyethyl)butyl]-) Related Products
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