Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C6H12OS |
| Molecular Weight | 132.224 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCC(S)CC=O
InChI
InChIKey=MMODARXIJRCRGL-UHFFFAOYSA-N
InChI=1S/C6H12OS/c1-2-3-6(8)4-5-7/h5-6,8H,2-4H2,1H3
| Molecular Formula | C6H12OS |
| Molecular Weight | 132.224 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Synthesis and sensorial properties of mercaptoaldehydes. | 2002 Sep 25 |
|
| Stereoselectivity of the generation of 3-mercaptohexanal and 3-mercaptohexanol by lipase-catalyzed hydrolysis of 3-acetylthioesters. | 2003 Jul 16 |
|
| Stereochemical course of the generation of 3-mercaptohexanal and 3-mercaptohexanol by beta-lyase-catalyzed cleavage of cysteine conjugates. | 2004 Jan 14 |
Patents
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 00:20:58 GMT 2023
by
admin
on
Sat Dec 16 00:20:58 GMT 2023
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| Record UNII |
7YS9XL4686
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| Record Status |
Validated (UNII)
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| Record Version |
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JECFA EVALUATION |
3-MERCAPTOHEXANAL
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DTXSID60966057
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527445
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7YS9XL4686
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1907
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C477018
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