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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14O4
Molecular Weight 210.2265
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-butanone

SMILES

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

InChI

InChIKey=KJSXBSGVNXDECP-UHFFFAOYSA-N
InChI=1S/C11H14O4/c1-7(12)5-10(14)8-3-4-9(13)11(6-8)15-2/h3-4,6,10,13-14H,5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C11H14O4
Molecular Weight 210.2265
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:18:00 GMT 2025
Edited
by admin
on Tue Apr 01 20:18:00 GMT 2025
Record UNII
55Z22HWN3G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Butanone, 4-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-
Preferred Name English
4-Hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-butanone
Systematic Name English
4-Hydroxy-4-(4-hydroxy-3-methoxyphenyl)butan-2-one
Systematic Name English
Code System Code Type Description
FDA UNII
55Z22HWN3G
Created by admin on Tue Apr 01 20:18:00 GMT 2025 , Edited by admin on Tue Apr 01 20:18:00 GMT 2025
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EPA CompTox
DTXSID10820291
Created by admin on Tue Apr 01 20:18:00 GMT 2025 , Edited by admin on Tue Apr 01 20:18:00 GMT 2025
PRIMARY
CAS
61152-59-8
Created by admin on Tue Apr 01 20:18:00 GMT 2025 , Edited by admin on Tue Apr 01 20:18:00 GMT 2025
PRIMARY
PUBCHEM
71398902
Created by admin on Tue Apr 01 20:18:00 GMT 2025 , Edited by admin on Tue Apr 01 20:18:00 GMT 2025
PRIMARY