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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4FNO
Molecular Weight 137.1112
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-Fluorophenyl isocyanate

SMILES

FC1=CC=C(C=C1)N=C=O

InChI

InChIKey=DSVGFKBFFICWLZ-UHFFFAOYSA-N
InChI=1S/C7H4FNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H

HIDE SMILES / InChI

Molecular Formula C7H4FNO
Molecular Weight 137.1112
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:03:40 GMT 2025
Edited
by admin
on Tue Apr 01 19:03:40 GMT 2025
Record UNII
B2A7JE8GHW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Fluorophenyl isocyanate
Systematic Name English
NSC-82348
Preferred Name English
4-Fluoro-1-isocyanatobenzene
Systematic Name English
4-Fluoroisocyanatobenzene
Systematic Name English
1-Fluoro-4-isocyanatobenzene
Systematic Name English
p-Fluorophenyl isocyanate
Systematic Name English
Benzene, 1-fluoro-4-isocyanato-
Systematic Name English
Isocyanic acid, p-fluorophenyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00152472
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY
PUBCHEM
70955
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY
NSC
82348
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-799-0
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY
FDA UNII
B2A7JE8GHW
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY
CAS
1195-45-5
Created by admin on Tue Apr 01 19:03:40 GMT 2025 , Edited by admin on Tue Apr 01 19:03:40 GMT 2025
PRIMARY