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Details

Stereochemistry RACEMIC
Molecular Formula C10H20O2S
Molecular Weight 204.33
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-MERCAPTOETHYL 2-ETHYLHEXANOATE

SMILES

CCCCC(CC)C(=O)OCCS

InChI

InChIKey=GLZUYMAJJWRTGR-UHFFFAOYSA-N
InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)10(11)12-7-8-13/h9,13H,3-8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H20O2S
Molecular Weight 204.33
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:06:13 GMT 2023
Edited
by admin
on Sat Dec 16 19:06:13 GMT 2023
Record UNII
5TNU9SB6FC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-MERCAPTOETHYL 2-ETHYLHEXANOATE
Systematic Name English
2-SULFANYLETHYL 2-ETHYLHEXANOATE
Systematic Name English
HEXANOIC ACID, 2-ETHYL-, 2-MERCAPTOETHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
67859-57-8
Created by admin on Sat Dec 16 19:06:13 GMT 2023 , Edited by admin on Sat Dec 16 19:06:13 GMT 2023
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FDA UNII
5TNU9SB6FC
Created by admin on Sat Dec 16 19:06:13 GMT 2023 , Edited by admin on Sat Dec 16 19:06:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID20886964
Created by admin on Sat Dec 16 19:06:13 GMT 2023 , Edited by admin on Sat Dec 16 19:06:13 GMT 2023
PRIMARY
PUBCHEM
106912
Created by admin on Sat Dec 16 19:06:13 GMT 2023 , Edited by admin on Sat Dec 16 19:06:13 GMT 2023
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