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Details

Stereochemistry ACHIRAL
Molecular Formula C7H11O4.Na
Molecular Weight 182.1496
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM MONOMETHYL ADIPATE

SMILES

[Na+].COC(=O)CCCCC([O-])=O

InChI

InChIKey=XWMAGYLNUHTFKC-UHFFFAOYSA-M
InChI=1S/C7H12O4.Na/c1-11-7(10)5-3-2-4-6(8)9;/h2-5H2,1H3,(H,8,9);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Oxidation of cyclohexanediol derivatives with 12-tungstophosphoric acid-hydrogen peroxide system.
2009
Patents
Name Type Language
SODIUM MONOMETHYL ADIPATE
Systematic Name English
MONOMETHYL ADIPATE SODIUM SALT
Systematic Name English
HEXANEDIOIC ACID, MONOMETHYL ESTER, SODIUM SALT
Systematic Name English
ADIPIC ACID, MONOMETHYL ESTER, SODIUM SALT
Systematic Name English
ADIPIC ACID, METHYL ESTER, SODIUM SALT
Systematic Name English
HEXANEDIOIC ACID, 1-METHYL ESTER, SODIUM SALT (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
23695427
Created by admin on Sat Dec 16 02:12:27 GMT 2023 , Edited by admin on Sat Dec 16 02:12:27 GMT 2023
PRIMARY
CAS
5877-45-2
Created by admin on Sat Dec 16 02:12:27 GMT 2023 , Edited by admin on Sat Dec 16 02:12:27 GMT 2023
PRIMARY
FDA UNII
IN3YY3XYIK
Created by admin on Sat Dec 16 02:12:27 GMT 2023 , Edited by admin on Sat Dec 16 02:12:27 GMT 2023
PRIMARY
CAS
627-91-8
Created by admin on Sat Dec 16 02:12:27 GMT 2023 , Edited by admin on Sat Dec 16 02:12:27 GMT 2023
MAJOR COMPONENT STRUCTURE/SEQUENCE