Benzyl 2,5-dihydro-2,5-dioxo-1H-pyrrole-1-carboxylate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H9NO4
Molecular Weight	231.2042
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Benzyl 2,5-dihydro-2,5-dioxo-1H-pyrrole-1-carboxylate

Structure Search

SMILES

O=C(OCC1=CC=CC=C1)N2C(=O)C=CC2=O

InChI

InChIKey=FACGDKXRLCOWHU-UHFFFAOYSA-N

InChI=1S/C12H9NO4/c14-10-6-7-11(15)13(10)12(16)17-8-9-4-2-1-3-5-9/h1-7H,8H2

HIDE SMILES / InChI

Molecular Formula	C12H9NO4
Molecular Weight	231.2042
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 19:21:49 GMT 2025` Edited by `admin` on `Tue Apr 01 19:21:49 GMT 2025`
Record UNII	X6X7UE45H5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Pyrrole-1-carboxylic acid, 2,5-dihydro-2,5-dioxo-, phenylmethyl ester

Preferred Name

English

Benzyl 2,5-dihydro-2,5-dioxo-1H-pyrrole-1-carboxylate

Systematic Name

English

Phenylmethyl 2,5-dihydro-2,5-dioxo-1H-pyrrole-1-carboxylate

Systematic Name

English

Code System Code Type Description

FDA UNII

X6X7UE45H5

Created by admin on Tue Apr 01 19:21:49 GMT 2025 , Edited by admin on Tue Apr 01 19:21:49 GMT 2025

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ECHA (EC/EINECS)

259-793-9

Created by admin on Tue Apr 01 19:21:49 GMT 2025 , Edited by admin on Tue Apr 01 19:21:49 GMT 2025

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CAS

55750-51-1

Created by admin on Tue Apr 01 19:21:49 GMT 2025 , Edited by admin on Tue Apr 01 19:21:49 GMT 2025

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EPA CompTox

DTXSID30204312

Created by admin on Tue Apr 01 19:21:49 GMT 2025 , Edited by admin on Tue Apr 01 19:21:49 GMT 2025

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PUBCHEM

3016993

Created by admin on Tue Apr 01 19:21:49 GMT 2025 , Edited by admin on Tue Apr 01 19:21:49 GMT 2025

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