o-Nitrophenoxyacetone

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9NO4
Molecular Weight	195.1721
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of o-Nitrophenoxyacetone

Structure Search

SMILES

CC(=O)COC1=C(C=CC=C1)[N+]([O-])=O

InChI

InChIKey=PYVMIAYOZLGBQM-UHFFFAOYSA-N

InChI=1S/C9H9NO4/c1-7(11)6-14-9-5-3-2-4-8(9)10(12)13/h2-5H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H9NO4
Molecular Weight	195.1721
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 18:52:34 GMT 2025` Edited by `admin` on `Mon Mar 31 18:52:34 GMT 2025`
Record UNII	Z5WWN9Z5C8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

o-Nitrophenoxyacetone

Systematic Name

English

NSC-2506

Preferred Name

English

Nitrophenoxyacetone, o-

Common Name

English

2-Propanone, 1-(2-nitrophenoxy)-

Systematic Name

English

1-(2-Nitrophenoxy)-2-propanone

Systematic Name

English

Code System Code Type Description

CAS

5330-66-5

Created by admin on Mon Mar 31 18:52:34 GMT 2025 , Edited by admin on Mon Mar 31 18:52:34 GMT 2025

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FDA UNII

Z5WWN9Z5C8

Created by admin on Mon Mar 31 18:52:34 GMT 2025 , Edited by admin on Mon Mar 31 18:52:34 GMT 2025

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EPA CompTox

DTXSID0063783

Created by admin on Mon Mar 31 18:52:34 GMT 2025 , Edited by admin on Mon Mar 31 18:52:34 GMT 2025

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NSC

2506

Created by admin on Mon Mar 31 18:52:34 GMT 2025 , Edited by admin on Mon Mar 31 18:52:34 GMT 2025

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PUBCHEM

79239

Created by admin on Mon Mar 31 18:52:34 GMT 2025 , Edited by admin on Mon Mar 31 18:52:34 GMT 2025

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