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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 4-HYDROXY-3-METHOXYPHENYLACETONITRILE

SMILES

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

InChI

InChIKey=SDVYWMWQCJEYTC-UHFFFAOYSA-N
InChI=1S/C9H9NO2/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,11H,4H2,1H3

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 Sat Dec 16 12:12:41 GMT 2023
Edited
by admin
on Sat Dec 16 12:12:41 GMT 2023
Record UNII
KBJ5T7NP94
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXY-3-METHOXYPHENYLACETONITRILE
Systematic Name English
2-METHOXY-4-(CYANOMETHYL)PHENOL
Systematic Name English
BENZENEACETONITRILE, 4-HYDROXY-3-METHOXY-
Systematic Name English
2-(4-HYDROXY-3-METHOXYPHENYL)ACETONITRILE
Systematic Name English
HOMOVANILLONITRILE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00196275
Created by admin on Sat Dec 16 12:12:41 GMT 2023 , Edited by admin on Sat Dec 16 12:12:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
224-739-5
Created by admin on Sat Dec 16 12:12:41 GMT 2023 , Edited by admin on Sat Dec 16 12:12:41 GMT 2023
PRIMARY
CAS
4468-59-1
Created by admin on Sat Dec 16 12:12:41 GMT 2023 , Edited by admin on Sat Dec 16 12:12:41 GMT 2023
PRIMARY
FDA UNII
KBJ5T7NP94
Created by admin on Sat Dec 16 12:12:41 GMT 2023 , Edited by admin on Sat Dec 16 12:12:41 GMT 2023
PRIMARY
PUBCHEM
78220
Created by admin on Sat Dec 16 12:12:41 GMT 2023 , Edited by admin on Sat Dec 16 12:12:41 GMT 2023
PRIMARY