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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11NO
Molecular Weight 161.2004
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Phenoxybutyronitrile

SMILES

N#CCCCOC1=CC=CC=C1

InChI

InChIKey=ZOLWCAUQCGRDGA-UHFFFAOYSA-N
InChI=1S/C10H11NO/c11-8-4-5-9-12-10-6-2-1-3-7-10/h1-3,6-7H,4-5,9H2

HIDE SMILES / InChI

Molecular Formula C10H11NO
Molecular Weight 161.2004
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 19:15:54 GMT 2025
Edited
by admin
on Tue Apr 01 19:15:54 GMT 2025
Record UNII
F3XR56M5Y6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-1845
Preferred Name English
4-Phenoxybutyronitrile
Systematic Name English
4-Phenoxybutanenitrile
Systematic Name English
Butanenitrile, 4-phenoxy-
Systematic Name English
Code System Code Type Description
NSC
1845
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY
PUBCHEM
75238
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY
FDA UNII
F3XR56M5Y6
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY
CAS
2243-43-8
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-812-0
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY
EPA CompTox
DTXSID80176954
Created by admin on Tue Apr 01 19:15:54 GMT 2025 , Edited by admin on Tue Apr 01 19:15:54 GMT 2025
PRIMARY