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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N2S
Molecular Weight 150.201
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of p-Thiocyanatoaniline

SMILES

NC1=CC=C(SC#N)C=C1

InChI

InChIKey=NJYFRQQXXXRJHK-UHFFFAOYSA-N
InChI=1S/C7H6N2S/c8-5-10-7-3-1-6(9)2-4-7/h1-4H,9H2

HIDE SMILES / InChI

Molecular Formula C7H6N2S
Molecular Weight 150.201
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 Tue Apr 01 19:35:49 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:49 GMT 2025
Record UNII
Q83LHW6L5V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-227955
Preferred Name English
p-Thiocyanatoaniline
Systematic Name English
Thiocyanic acid, p-aminophenyl ester
Systematic Name English
Thiocyanic acid, 4-aminophenyl ester
Systematic Name English
4-Thiocyanatobenzenamine
Systematic Name English
AI3-24798
Code English
1-Amino-4-thiocyanatobenzene
Systematic Name English
Aniline, p-thiocyanato-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20183985
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
NSC
227955
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
PUBCHEM
76336
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
FDA UNII
Q83LHW6L5V
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
CAS
2987-46-4
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY