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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO2
Molecular Weight 163.1733
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(CYANOMETHYL)-3,5-DIMETHOXYBENZENE

SMILES

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

InChI

InChIKey=NVTHWSJNXVDIKR-UHFFFAOYSA-N
InChI=1S/C9H9NO2/c1-11-8-3-7(6-10)4-9(5-8)12-2/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H9NO2
Molecular Weight 163.1733
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 19:12:08 GMT 2025
Edited
by admin
on Tue Apr 01 19:12:08 GMT 2025
Record UNII
8OJ1LY7B4L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(CYANOMETHYL)-3,5-DIMETHOXYBENZENE
Systematic Name English
NSC-73710
Preferred Name English
3,5-DIMETHOXYBENZONITRILE
Systematic Name English
BENZONITRILE, 3,5-DIMETHOXY-
Systematic Name English
Code System Code Type Description
NSC
73710
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY
ECHA (EC/EINECS)
242-858-0
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY
PUBCHEM
29482
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY
CAS
19179-31-8
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY
FDA UNII
8OJ1LY7B4L
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID40172710
Created by admin on Tue Apr 01 19:12:08 GMT 2025 , Edited by admin on Tue Apr 01 19:12:08 GMT 2025
PRIMARY