U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H10O5
Molecular Weight 210.1834
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETHYL 4-HYDROXYISOPHTHALATE

SMILES

COC(=O)C1=CC=C(O)C(=C1)C(=O)OC

InChI

InChIKey=ALBUJVBOIXVVLS-UHFFFAOYSA-N
InChI=1S/C10H10O5/c1-14-9(12)6-3-4-8(11)7(5-6)10(13)15-2/h3-5,11H,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Patents

Patents

06995151
1
Name Type Language
DIMETHYL 4-HYDROXYISOPHTHALATE
Systematic Name English
4-HYDROXYISOPHTHALIC ACID DIMETHYL ESTER [MI]
Common Name English
METHYL SALICYLATE IMPURITY E [EP IMPURITY]
Common Name English
NSC-109108
Code English
1,3-BENZENEDICARBOXYLIC ACID, 4-HYDROXY-, DIMETHYL ESTER
Common Name English
METHYL SALICYLATE RELATED COMPOUND A [USP-RS]
Common Name English
4-HYDROXYISOPHTHALIC ACID DIMETHYL ESTER
MI  
Systematic Name English
ISOPHTHALIC ACID, 4-HYDROXY-, DIMETHYL ESTER
Common Name English
METHYL SALICYLATE RELATED COMPOUND A
USP-RS  
Common Name English
Code System Code Type Description
RS_ITEM_NUM
1437461
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
CAS
5985-24-0
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID7064075
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
FDA UNII
M57C256V9R
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
NSC
109108
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
227-803-0
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
PUBCHEM
80087
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY
MERCK INDEX
m6136
Created by admin on Fri Dec 15 16:13:52 GMT 2023 , Edited by admin on Fri Dec 15 16:13:52 GMT 2023
PRIMARY Merck Index
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966