BENZYL THIOCYANATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7NS
Molecular Weight	149.213
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N#CSCC1=CC=CC=C1

InChI

InChIKey=ABNDFSOIUFLJAH-UHFFFAOYSA-N

InChI=1S/C8H7NS/c9-7-10-6-8-4-2-1-3-5-8/h1-5H,6H2

HIDE SMILES / InChI

Molecular Formula	C8H7NS
Molecular Weight	149.213
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Validation of Different Methods of Preparation of Adhatoda vasica Leaf Juice by Quantification of Total Alkaloids and Vasicine.	2008-01	20390078
Palladium-catalyzed, copper(I)-mediated coupling of boronic acids and benzylthiocyanate. A cyanide-free cyanation of boronic acids.	2006-09-14	16956219
Phenethyl isothiocyanate triggers apoptosis in Jurkat cells made resistant by the overexpression of Bcl-2.	2006-07-01	16818653
Regioselective bond cleavage in the dissociative electron transfer to benzyl thiocyanates: the role of radical/ion pair formation.	2006-05-24	16704259
Structure-activity relationship of S-benzylisothiourea derivatives to induce spherical cells in Escherichia coli.	2004-11	15564663
Regioselective bond cleavage in the dissociative electron transfer to benzyl thiocyanates.	2003-10-22	14558793
Involvement of toxicity as an early event in urinary bladder carcinogenesis induced by phenethyl isothiocyanate, benzyl isothiocyanate, and analogues in F344 rats.	2003-07-10	12851104
Composition of the essential oil of Lepidium meyenii (Walp).	2002-09	12169308
Preparation of 2,6-dimethyl-4-arylpyridine- 3,5-dicarbonitrile: a paired electrosynthesis.	2002-04-05	11925258
Major proteins related to chlortetracycline biosynthesis in a Streptomyces aureofaciens production strain studied by quantitative proteomics.	2001-12	11778884
Benzyl isothiocyanate is the chief or sole anthelmintic in papaya seed extracts.	2001-06	11393524
Polarographic investigation of reduction process of some azodyes and their complexes with rare earths.	2001-04-12	18968244

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:22:47 GMT 2025` Edited by `admin` on `Mon Mar 31 19:22:47 GMT 2025`
Record UNII	YX8TAO9O90
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-130266

Preferred Name

English

BENZYL THIOCYANATE

Systematic Name

English

Benzyl thiocyanate [WHO-DD]

Common Name

English

NSC-1729

Code

English

Code System Code Type Description

EPA CompTox

DTXSID5020156