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Details

Stereochemistry ACHIRAL
Molecular Formula C6H11NS2
Molecular Weight 161.288
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(METHYLTHIO)BUTYL THIOCYANATE

SMILES

CSCCCCSC#N

InChI

InChIKey=FUCWJZPPDWREHP-UHFFFAOYSA-N
InChI=1S/C6H11NS2/c1-8-4-2-3-5-9-6-7/h2-5H2,1H3

HIDE SMILES / InChI

Molecular Formula C6H11NS2
Molecular Weight 161.288
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 07:29:36 GMT 2025
Edited
by admin
on Wed Apr 02 07:29:36 GMT 2025
Record UNII
1SCS723I0R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(METHYLTHIO)BUTYL THIOCYANATE
Common Name English
THIOCYANIC ACID, 4-(METHYLTHIO)BUTYL ESTER
Preferred Name English
4-METHYLSULFANYLBUTYL THIOCYANATE
Systematic Name English
1-(METHYLTHIO)-4-THIOCYANOBUTANE
Systematic Name English
Code System Code Type Description
CAS
41756-12-1
Created by admin on Wed Apr 02 07:29:36 GMT 2025 , Edited by admin on Wed Apr 02 07:29:36 GMT 2025
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EPA CompTox
DTXSID601266445
Created by admin on Wed Apr 02 07:29:36 GMT 2025 , Edited by admin on Wed Apr 02 07:29:36 GMT 2025
PRIMARY
FDA UNII
1SCS723I0R
Created by admin on Wed Apr 02 07:29:36 GMT 2025 , Edited by admin on Wed Apr 02 07:29:36 GMT 2025
PRIMARY
PUBCHEM
89295500
Created by admin on Wed Apr 02 07:29:36 GMT 2025 , Edited by admin on Wed Apr 02 07:29:36 GMT 2025
PRIMARY