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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 2,5-Dimethoxybenzonitrile

SMILES

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

InChI

InChIKey=HWAMEJIMXIXLIH-UHFFFAOYSA-N
InChI=1S/C9H9NO2/c1-11-8-3-4-9(12-2)7(5-8)6-10/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 19:18:41 GMT 2025
Edited
by admin
on Tue Apr 01 19:18:41 GMT 2025
Record UNII
4Z9ABJ2RLU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-27019
Preferred Name English
2,5-Dimethoxybenzonitrile
Systematic Name English
Benzonitrile, 2,5-dimethoxy-
Systematic Name English
Code System Code Type Description
FDA UNII
4Z9ABJ2RLU
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
PRIMARY
CAS
5312-97-0
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
PRIMARY
NSC
27019
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
PRIMARY
PUBCHEM
79200
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
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EPA CompTox
DTXSID70201209
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
PRIMARY
ECHA (EC/EINECS)
226-169-2
Created by admin on Tue Apr 01 19:18:41 GMT 2025 , Edited by admin on Tue Apr 01 19:18:41 GMT 2025
PRIMARY