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Details

Stereochemistry ACHIRAL
Molecular Formula C8H4F3NO
Molecular Weight 187.1187
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE

SMILES

FC(F)(F)C1=CC=CC=C1N=C=O

InChI

InChIKey=GZWGTVZRRFPVAS-UHFFFAOYSA-N
InChI=1S/C8H4F3NO/c9-8(10,11)6-3-1-2-4-7(6)12-5-13/h1-4H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
Systematic Name English
ISOCYANIC ACID, (ALPHA,ALPHA,ALPHA-TRIFLUORO-O-TOLYL) ESTER
Preferred Name English
BENZENE, 1-ISOCYANATO-2-(TRIFLUOROMETHYL)-
Systematic Name English
O-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
Systematic Name English
1-ISOCYANATO-2-(TRIFLUOROMETHYL)BENZENE
Systematic Name English
ALPHA,ALPHA,ALPHA-TRIFLUORO-O-TOLYL ISOCYANATE
Systematic Name English
O-TRIFLUOROMETHYLPHENYLISOCYANATE
Common Name English
Code System Code Type Description
FDA UNII
UWK587J8BW
Created by admin on Wed Apr 02 10:11:12 GMT 2025 , Edited by admin on Wed Apr 02 10:11:12 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-925-5
Created by admin on Wed Apr 02 10:11:12 GMT 2025 , Edited by admin on Wed Apr 02 10:11:12 GMT 2025
PRIMARY
CAS
2285-12-3
Created by admin on Wed Apr 02 10:11:12 GMT 2025 , Edited by admin on Wed Apr 02 10:11:12 GMT 2025
PRIMARY
PUBCHEM
16794
Created by admin on Wed Apr 02 10:11:12 GMT 2025 , Edited by admin on Wed Apr 02 10:11:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID10177393
Created by admin on Wed Apr 02 10:11:12 GMT 2025 , Edited by admin on Wed Apr 02 10:11:12 GMT 2025
PRIMARY
NIH
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