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Details

Stereochemistry RACEMIC
Molecular Formula C10H11NS
Molecular Weight 177.266
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AMPHETAMINE ISOTHIOCYANATE

SMILES

CC(CC1=CC=CC=C1)N=C=S

InChI

InChIKey=AFKRLUUCCIMVQP-UHFFFAOYSA-N
InChI=1S/C10H11NS/c1-9(11-8-12)7-10-5-3-2-4-6-10/h2-6,9H,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H11NS
Molecular Weight 177.266
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:56:57 GMT 2023
Edited
by admin
on Sat Dec 16 16:56:57 GMT 2023
Record UNII
R6SN3Y72K6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMPHETAMINE ISOTHIOCYANATE
Common Name English
(2-ISOTHIOCYANATOPROPYL)BENZENE
Systematic Name English
ALPHA-METHYLPHENETHYL ISOTHIOCYANATE
Systematic Name English
ISOTHIOCYANIC ACID, .ALPHA.-METHYLPHENETHYL ESTER
Systematic Name English
.BETA.-PHENYLISOPROPYLISOTHIOCYANATE
Common Name English
BENZENE, (2-ISOTHIOCYANATOPROPYL)-
Systematic Name English
Code System Code Type Description
CAS
16220-05-6
Created by admin on Sat Dec 16 16:56:57 GMT 2023 , Edited by admin on Sat Dec 16 16:56:57 GMT 2023
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FDA UNII
R6SN3Y72K6
Created by admin on Sat Dec 16 16:56:57 GMT 2023 , Edited by admin on Sat Dec 16 16:56:57 GMT 2023
PRIMARY
PUBCHEM
85976
Created by admin on Sat Dec 16 16:56:57 GMT 2023 , Edited by admin on Sat Dec 16 16:56:57 GMT 2023
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EPA CompTox
DTXSID20936650
Created by admin on Sat Dec 16 16:56:57 GMT 2023 , Edited by admin on Sat Dec 16 16:56:57 GMT 2023
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