1,3-BENZODIOXOLE-5-METHANOL, FORMATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H8O4
Molecular Weight	180.1574
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-BENZODIOXOLE-5-METHANOL, FORMATE

Structure Search

SMILES

O=COCC1=CC=C2OCOC2=C1

InChI

InChIKey=ZPQGZTFOFQEGAF-UHFFFAOYSA-N

InChI=1S/C9H8O4/c10-5-11-4-7-1-2-8-9(3-7)13-6-12-8/h1-3,5H,4,6H2

HIDE SMILES / InChI

Molecular Formula	C9H8O4
Molecular Weight	180.1574
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 `Mon Mar 31 18:51:55 GMT 2025` Edited by `admin` on `Mon Mar 31 18:51:55 GMT 2025`
Record UNII	J6CA72JCR6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,3-BENZODIOXOLE-5-METHANOL, FORMATE

Systematic Name

English

NSC-405156

Preferred Name

English

BENZO(D)(1,3)DIOXOL-5-YLMETHYL FORMATE

Systematic Name

English

3,4-METHYLENEDIOXYBENZYL FORMATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID701005753

Created by admin on Mon Mar 31 18:51:55 GMT 2025 , Edited by admin on Mon Mar 31 18:51:55 GMT 2025

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CAS

85262-96-0

Created by admin on Mon Mar 31 18:51:55 GMT 2025 , Edited by admin on Mon Mar 31 18:51:55 GMT 2025

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FDA UNII

J6CA72JCR6

Created by admin on Mon Mar 31 18:51:55 GMT 2025 , Edited by admin on Mon Mar 31 18:51:55 GMT 2025

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NSC

405156

Created by admin on Mon Mar 31 18:51:55 GMT 2025 , Edited by admin on Mon Mar 31 18:51:55 GMT 2025

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PUBCHEM

101285

Created by admin on Mon Mar 31 18:51:55 GMT 2025 , Edited by admin on Mon Mar 31 18:51:55 GMT 2025

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