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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO
Molecular Weight 147.1739
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (3-Methoxyphenyl)acetonitrile

SMILES

COC1=CC(CC#N)=CC=C1

InChI

InChIKey=LXKNAUOWEJWGTE-UHFFFAOYSA-N
InChI=1S/C9H9NO/c1-11-9-4-2-3-8(7-9)5-6-10/h2-4,7H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H9NO
Molecular Weight 147.1739
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 19:24:13 GMT 2025
Edited
by admin
on Tue Apr 01 19:24:13 GMT 2025
Record UNII
7W4V7EEP5V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-143401
Preferred Name English
(3-Methoxyphenyl)acetonitrile
Systematic Name English
(m-Methoxyphenyl)acetonitrile
Systematic Name English
Benzeneacetonitrile, 3-methoxy-
Systematic Name English
3-Methoxybenzeneacetonitrile
Systematic Name English
Code System Code Type Description
FDA UNII
7W4V7EEP5V
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY
EPA CompTox
DTXSID60173704
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY
PUBCHEM
88310
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY
NSC
143401
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY
CAS
19924-43-7
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY
ECHA (EC/EINECS)
243-428-5
Created by admin on Tue Apr 01 19:24:13 GMT 2025 , Edited by admin on Tue Apr 01 19:24:13 GMT 2025
PRIMARY