Cas no 7005-18-7 (2-amino-4-methylsulfanyl-butanoic acid)
7005-18-7 structure
Product Name:2-amino-4-methylsulfanyl-butanoic acid
CAS No:7005-18-7
MF:C5H11NO2S
MW:149.21134018898
CID:974550
Update Time:2025-04-19
2-amino-4-methylsulfanyl-butanoic acid Chemical and Physical Properties
Names and Identifiers
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- 2-amino-4-methylsulfanyl-butanoic acid
- 2-Ammonio-4-(methylsulfanyl)butanoate
- D-METHIONINE
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- Inchi： 1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
- InChI Key： FFEARJCKVFRZRR-UHFFFAOYSA-N
- SMILES： CSCCC(C(=O)O)N
Computed Properties
- Exact Mass: 149.05113
- Monoisotopic Mass: 149.051049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 97
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _1.9
- Topological Polar Surface Area: 88.6
Experimental Properties
- Melting Point: 280-282 deg C (decomposes, sealed capillary)
- Boiling Point: 181 deg C (decomposes)
- PSA: 63.32
2-amino-4-methylsulfanyl-butanoic acid 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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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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