5-MESYL-6-NITROBENZOXAZOL-2(3H)-ONE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H6N2O6S
Molecular Weight	258.208
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-MESYL-6-NITROBENZOXAZOL-2(3H)-ONE

Structure Search

SMILES

CS(=O)(=O)C1=CC2=C(OC(=O)N2)C=C1[N+]([O-])=O

InChI

InChIKey=MVPPGNRJNZBDAK-UHFFFAOYSA-N

InChI=1S/C8H6N2O6S/c1-17(14,15)7-2-4-6(16-8(11)9-4)3-5(7)10(12)13/h2-3H,1H3,(H,9,11)

HIDE SMILES / InChI

Molecular Formula	C8H6N2O6S
Molecular Weight	258.208
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 16:54:22 GMT 2025` Edited by `admin` on `Tue Apr 01 16:54:22 GMT 2025`
Record UNII	PVS5RED5CG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-MESYL-6-NITROBENZOXAZOL-2(3H)-ONE

Systematic Name

English

2(3H)-BENZOXAZOLONE, 5-(METHYLSULFONYL)-6-NITRO-

Preferred Name

English

5-(METHYLSULFONYL)-6-NITRO-2(3H)-BENZOXAZOLONE

Common Name

English

Code System Code Type Description

FDA UNII

PVS5RED5CG

Created by admin on Tue Apr 01 16:54:22 GMT 2025 , Edited by admin on Tue Apr 01 16:54:22 GMT 2025

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ECHA (EC/EINECS)

250-795-5

Created by admin on Tue Apr 01 16:54:22 GMT 2025 , Edited by admin on Tue Apr 01 16:54:22 GMT 2025

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PUBCHEM

3015594

Created by admin on Tue Apr 01 16:54:22 GMT 2025 , Edited by admin on Tue Apr 01 16:54:22 GMT 2025

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EPA CompTox

DTXSID90185638

Created by admin on Tue Apr 01 16:54:22 GMT 2025 , Edited by admin on Tue Apr 01 16:54:22 GMT 2025

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CAS

31770-95-3

Created by admin on Tue Apr 01 16:54:22 GMT 2025 , Edited by admin on Tue Apr 01 16:54:22 GMT 2025

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