Cas no 6367-70-0 (L-Homocysteine,S-(2-aminoethyl)-, monohydrochloride (9CI))
6367-70-0 structure
Product Name:L-Homocysteine,S-(2-aminoethyl)-, monohydrochloride (9CI)
CAS No:6367-70-0
MF:C6H15ClN2O2S
MW:214.713499307632
CID:521054
PubChem ID:22854
Update Time:2025-04-19
L-Homocysteine,S-(2-aminoethyl)-, monohydrochloride (9CI) Chemical and Physical Properties
Names and Identifiers
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- L-Homocysteine,S-(2-aminoethyl)-, monohydrochloride (9CI)
- 5-(2-aminoethyl)homocysteine
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- Inchi： 1S/C6H14N2O2S.ClH/c7-2-4-11-3-1-5(8)6(9)10;/h5H,1-4,7-8H2,(H,9,10);1H/t5-;/m1./s1
- InChI Key： LOFVOIGYXQLCIM-NUBCRITNSA-N
- SMILES： [Cl-].S(CC[NH3+])CC[C@H](C(=O)O)N
Computed Properties
- Exact Mass: 198.937
- Monoisotopic Mass: 214.0542766g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 121
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 81.57
L-Homocysteine,S-(2-aminoethyl)-, monohydrochloride (9CI) Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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