PROPYL 3,4,5-TRIMETHOXYBENZOATE

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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 PROPYL 3,4,5-TRIMETHOXYBENZOATE

Structure Search

SMILES

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

InChI

InChIKey=FZUOVWLTJMRMHO-UHFFFAOYSA-N

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

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 12:02:02 GMT 2023` Edited by `admin` on `Sat Dec 16 12:02:02 GMT 2023`
Record UNII	J2W7BC2P46
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PROPYL 3,4,5-TRIMETHOXYBENZOATE

Systematic Name

English

BENZOIC ACID, 3,4,5-TRIMETHOXY-, PROPYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

6178-45-6

Created by admin on Sat Dec 16 12:02:02 GMT 2023 , Edited by admin on Sat Dec 16 12:02:02 GMT 2023

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ECHA (EC/EINECS)

228-225-1

Created by admin on Sat Dec 16 12:02:02 GMT 2023 , Edited by admin on Sat Dec 16 12:02:02 GMT 2023

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EPA CompTox

DTXSID90210772

Created by admin on Sat Dec 16 12:02:02 GMT 2023 , Edited by admin on Sat Dec 16 12:02:02 GMT 2023

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PUBCHEM

80315

Created by admin on Sat Dec 16 12:02:02 GMT 2023 , Edited by admin on Sat Dec 16 12:02:02 GMT 2023

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FDA UNII

J2W7BC2P46

Created by admin on Sat Dec 16 12:02:02 GMT 2023 , Edited by admin on Sat Dec 16 12:02:02 GMT 2023

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