4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid
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![4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e4ed66e7333a4068a54a1e2ef71a427a.png "4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid")
4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid
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CAS No:
175201-70-4
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Formula:
C12H16N2O3S2
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Chemical Name:
4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid
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Synonyms:
4-(methylsulfanyl)-2-{[2-(methylsulfanyl)pyridin-3-yl]formamido}butanoic acid; HMS554I16; 4-(methylthio)-2-(([2-(methylthio)-3-pyridyl]carbonyl)amino)butanoic acid;
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CAS No:
4-methylsulfanyl-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]butanoic acid Basic Attributes
300.39700
300.06023472
DTXSID40381002
2933399090
Characteristics
129.89000
2.13050
1.33g/cm3
157ºC
572.1ºC at 760 mmHg
299.8ºC
1.612
6.31E-14mmHg at 25°C
Computed Properties
Molecular Weight:300.4
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:300.06023472
Monoisotopic Mass:300.06023472
Topological Polar Surface Area:130
Heavy Atom Count:19
Complexity:315
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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