S-[2-(Acetylamino)ethyl] 3-oxobutanethioate
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![S-[2-(Acetylamino)ethyl] 3-oxobutanethioate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c3881b2922224e97a3d5ba662734ceea.png "S-[2-(Acetylamino)ethyl] 3-oxobutanethioate")
S-[2-(Acetylamino)ethyl] 3-oxobutanethioate
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CAS No:
23255-41-6
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Formula:
C8H13NO3S
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Chemical Name:
S-[2-(Acetylamino)ethyl] 3-oxobutanethioate
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Synonyms:
Butanethioic acid,3-oxo-,S-[2-(acetylamino)ethyl] ester;Acetoacetic acid,1-thio-,S-ester with N-(2-mercaptoethyl)acetamide;S-[2-(Acetylamino)ethyl] 3-oxobutanethioate;Acetoacetyl-N-acetylcysteamine;N-Acetyl-S-acetoacetylcysteamine;S-Acetoacetyl-N-acetylcysteamine;S-(2-Acetamidoethyl) 3-oxobutanethioate;3-Oxobutyryl-N-acetylcysteamine thioester
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CAS No:
Characteristics
88.5 Ų
1.163±0.06 g/cm3
39-42 °C @ Solvent: Ethanol, Acetone, Pentane
394.3±27.0 °C(Predicted)
8.71±0.46
Computed Properties
Molecular Weight:203.26
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:203.06161445
Monoisotopic Mass:203.06161445
Topological Polar Surface Area:88.5
Heavy Atom Count:13
Complexity:215
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
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Ethanethioic acid, S-[2-(acetylamino)ethyl] ester
1420-88-8
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S-butan-2-yl 3-oxobutanethioate
15780-64-0
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S-tert-butyl 3-oxobutanethioate
15925-47-0
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S-propan-2-yl 3-oxobutanethioate Formula
15780-62-8
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S-propyl 3-oxobutanethioate Formula
15780-61-7
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S-butyl 3-oxobutanethioate Formula
15780-63-9
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S-[2-(Acetylamino)ethyl] 2-butenethioate Structure
23784-20-5
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