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Details

Stereochemistry ACHIRAL
Molecular Formula C9H8O4
Molecular Weight 180.1574
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hydroxy-3-(hydroxymethyl)-?-oxobenzeneacetaldehyde

SMILES

OCC1=CC(=CC=C1O)C(=O)C=O

InChI

InChIKey=PHHYBIKJSAQUKQ-UHFFFAOYSA-N
InChI=1S/C9H8O4/c10-4-7-3-6(9(13)5-11)1-2-8(7)12/h1-3,5,10,12H,4H2

HIDE SMILES / InChI

Molecular Formula C9H8O4
Molecular Weight 180.1574
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 Wed Apr 02 21:13:58 GMT 2025
Edited
by admin
on Wed Apr 02 21:13:58 GMT 2025
Record UNII
LK4A8U6HPX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Hydroxy-3-(hydroxymethyl)-?-oxobenzeneacetaldehyde
Systematic Name English
Salbutamol Related Compound 2
Preferred Name English
Benzeneacetaldehyde, 4-hydroxy-3-(hydroxymethyl)-?-oxo-
Systematic Name English
Code System Code Type Description
PUBCHEM
169490940
Created by admin on Wed Apr 02 21:13:58 GMT 2025 , Edited by admin on Wed Apr 02 21:13:58 GMT 2025
PRIMARY
FDA UNII
LK4A8U6HPX
Created by admin on Wed Apr 02 21:13:58 GMT 2025 , Edited by admin on Wed Apr 02 21:13:58 GMT 2025
PRIMARY
CAS
51234-21-0
Created by admin on Wed Apr 02 21:13:58 GMT 2025 , Edited by admin on Wed Apr 02 21:13:58 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY