2,2'-Diethyl dihydrogen 4,4'-carbonylbisphthalate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H18O9
Molecular Weight	414.3622
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2'-Diethyl dihydrogen 4,4'-carbonylbisphthalate

Structure Search

SMILES

CCOC(=O)C1=CC(=CC=C1C(O)=O)C(=O)C2=CC(C(=O)OCC)=C(C=C2)C(O)=O

InChI

InChIKey=GUELVDUBXBMBMG-UHFFFAOYSA-N

InChI=1S/C21H18O9/c1-3-29-20(27)15-9-11(5-7-13(15)18(23)24)17(22)12-6-8-14(19(25)26)16(10-12)21(28)30-4-2/h5-10H,3-4H2,1-2H3,(H,23,24)(H,25,26)

HIDE SMILES / InChI

Molecular Formula	C21H18O9
Molecular Weight	414.3622
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:29:48 GMT 2025` Edited by `admin` on `Tue Apr 01 18:29:48 GMT 2025`
Record UNII	6T97YE5U2S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,2-Benzenedicarboxylic acid, 4,4?-carbonylbis-, 2,2?-diethyl ester

Preferred Name

English

2,2'-Diethyl dihydrogen 4,4'-carbonylbisphthalate

Systematic Name

English

Code System Code Type Description

PUBCHEM

104044

Created by admin on Tue Apr 01 18:29:48 GMT 2025 , Edited by admin on Tue Apr 01 18:29:48 GMT 2025

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FDA UNII

6T97YE5U2S

Created by admin on Tue Apr 01 18:29:48 GMT 2025 , Edited by admin on Tue Apr 01 18:29:48 GMT 2025

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CAS

51986-91-5

Created by admin on Tue Apr 01 18:29:48 GMT 2025 , Edited by admin on Tue Apr 01 18:29:48 GMT 2025

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EPA CompTox

DTXSID20199945

Created by admin on Tue Apr 01 18:29:48 GMT 2025 , Edited by admin on Tue Apr 01 18:29:48 GMT 2025

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ECHA (EC/EINECS)

257-578-4

Created by admin on Tue Apr 01 18:29:48 GMT 2025 , Edited by admin on Tue Apr 01 18:29:48 GMT 2025

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