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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10O2
Molecular Weight 150.1745
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ?-Hydroxy-4-methylbenzeneacetaldehyde, (?S)-

SMILES

CC1=CC=C(C=C1)[C@H](O)C=O

InChI

InChIKey=RAYOBZZZVWFDKL-SECBINFHSA-N
InChI=1S/C9H10O2/c1-7-2-4-8(5-3-7)9(11)6-10/h2-6,9,11H,1H3/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H10O2
Molecular Weight 150.1745
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:56:32 GMT 2025
Edited
by admin
on Wed Apr 02 20:56:32 GMT 2025
Record UNII
H7BQK9J8W5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
?-Hydroxy-4-methylbenzeneacetaldehyde, (?S)-
Systematic Name English
(?S)-?-Hydroxy-4-methylbenzeneacetaldehyde
Preferred Name English
Benzeneacetaldehyde, ?-hydroxy-4-methyl-, (?S)-
Systematic Name English
Code System Code Type Description
FDA UNII
H7BQK9J8W5
Created by admin on Wed Apr 02 20:56:32 GMT 2025 , Edited by admin on Wed Apr 02 20:56:32 GMT 2025
PRIMARY
CAS
1821771-23-6
Created by admin on Wed Apr 02 20:56:32 GMT 2025 , Edited by admin on Wed Apr 02 20:56:32 GMT 2025
PRIMARY
PUBCHEM
130026128
Created by admin on Wed Apr 02 20:56:32 GMT 2025 , Edited by admin on Wed Apr 02 20:56:32 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER