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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14O5
Molecular Weight 238.2366
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYL 4-HYDROXYISOPHTHALATE

SMILES

CCOC(=O)C1=CC(C(=O)OCC)=C(O)C=C1

InChI

InChIKey=BPSXYFMGSNKFDZ-UHFFFAOYSA-N
InChI=1S/C12H14O5/c1-3-16-11(14)8-5-6-10(13)9(7-8)12(15)17-4-2/h5-7,13H,3-4H2,1-2H3

HIDE SMILES / InChI

Approval Year

Patents

Patents

Name Type Language
DIETHYL 4-HYDROXYISOPHTHALATE
Systematic Name English
NSC-84110
Preferred Name English
1,3-BENZENEDICARBOXYLIC ACID, 4-HYDROXY-, 1,3-DIETHYL ESTER
Common Name English
ISOPHTHALIC ACID, 4-HYDROXY-, DIETHYL ESTER
Common Name English
4-HYDROXYISOPHTHALIC ACID DIETHYL ESTER [MI]
Common Name English
1,3-BENZENEDICARBOXYLIC ACID, 4-HYDROXY-, DIETHYL ESTER
Common Name English
Code System Code Type Description
PUBCHEM
256772
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY
FDA UNII
L907M9989M
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID90208573
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY
NSC
84110
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY
CAS
5985-25-1
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY
MERCK INDEX
m6136
Created by admin on Mon Mar 31 18:43:45 GMT 2025 , Edited by admin on Mon Mar 31 18:43:45 GMT 2025
PRIMARY Merck Index