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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5NO
Molecular Weight 119.1207
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYL CYANATE

SMILES

N#COC1=CC=CC=C1

InChI

InChIKey=CWHFDTWZHFRTAB-UHFFFAOYSA-N
InChI=1S/C7H5NO/c8-6-9-7-4-2-1-3-5-7/h1-5H

HIDE SMILES / InChI

Molecular Formula C7H5NO
Molecular Weight 119.1207
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 Wed Apr 02 10:47:46 GMT 2025
Edited
by admin
on Wed Apr 02 10:47:46 GMT 2025
Record UNII
9DU54RB472
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-CYANATOBENZENE
Preferred Name English
PHENYL CYANATE
Systematic Name English
CYANIC ACID, PHENYL ESTER
Systematic Name English
PHENYLCYANATE
Systematic Name English
Code System Code Type Description
PUBCHEM
70740
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY
CHEBI
38903
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID10149954
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY
FDA UNII
9DU54RB472
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-364-5
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY
CAS
1122-85-6
Created by admin on Wed Apr 02 10:47:47 GMT 2025 , Edited by admin on Wed Apr 02 10:47:47 GMT 2025
PRIMARY