1,3-Benzodioxol-2-one

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H4O3
Molecular Weight	136.1049
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-Benzodioxol-2-one

Structure Search

SMILES

O=C1OC2=C(O1)C=CC=C2

InChI

InChIKey=NZPSDGIEKAQVEZ-UHFFFAOYSA-N

InChI=1S/C7H4O3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H

HIDE SMILES / InChI

Molecular Formula	C7H4O3
Molecular Weight	136.1049
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 19:03:46 GMT 2025` Edited by `admin` on `Tue Apr 01 19:03:46 GMT 2025`
Record UNII	LK7FZ7X9DG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,3-Benzodioxol-2-one

Preferred Name

English

Code System Code Type Description

PUBCHEM

75112

Created by admin on Tue Apr 01 19:03:46 GMT 2025 , Edited by admin on Tue Apr 01 19:03:46 GMT 2025

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CAS

2171-74-6

Created by admin on Tue Apr 01 19:03:46 GMT 2025 , Edited by admin on Tue Apr 01 19:03:46 GMT 2025

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EPA CompTox

DTXSID3062231

Created by admin on Tue Apr 01 19:03:46 GMT 2025 , Edited by admin on Tue Apr 01 19:03:46 GMT 2025

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ECHA (EC/EINECS)

218-521-9

Created by admin on Tue Apr 01 19:03:46 GMT 2025 , Edited by admin on Tue Apr 01 19:03:46 GMT 2025

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FDA UNII

LK7FZ7X9DG

Created by admin on Tue Apr 01 19:03:46 GMT 2025 , Edited by admin on Tue Apr 01 19:03:46 GMT 2025

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