3,4,5-Triethoxybenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H18O5
Molecular Weight	254.279
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,4,5-Triethoxybenzoic acid

Structure Search

SMILES

CCOC1=CC(=CC(OCC)=C1OCC)C(O)=O

InChI

InChIKey=YCENSLDYFDZUMO-UHFFFAOYSA-N

InChI=1S/C13H18O5/c1-4-16-10-7-9(13(14)15)8-11(17-5-2)12(10)18-6-3/h7-8H,4-6H2,1-3H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C13H18O5
Molecular Weight	254.279
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 `Sat Dec 16 20:08:15 GMT 2023` Edited by `admin` on `Sat Dec 16 20:08:15 GMT 2023`
Record UNII	5NK2SPG7WE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,4,5-Triethoxybenzoic acid

Systematic Name

English

NSC-66202

Code

English

Benzoic acid, 3,4,5-triethoxy-

Systematic Name

English

Code System Code Type Description

FDA UNII

5NK2SPG7WE

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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ECHA (EC/EINECS)

230-192-3

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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NSC

66202

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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CAS

6970-19-0

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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EPA CompTox

DTXSID40219992

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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PUBCHEM

81432

Created by admin on Sat Dec 16 20:08:15 GMT 2023 , Edited by admin on Sat Dec 16 20:08:15 GMT 2023

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