3'-NITRO-4'-METHYLACETOPHENONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9NO3
Molecular Weight	179.1727
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3'-NITRO-4'-METHYLACETOPHENONE

Structure Search

SMILES

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

InChI

InChIKey=YRBBMDOBWRUMEZ-UHFFFAOYSA-N

InChI=1S/C9H9NO3/c1-6-3-4-8(7(2)11)5-9(6)10(12)13/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H9NO3
Molecular Weight	179.1727
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 `Sat Dec 16 12:55:24 GMT 2023` Edited by `admin` on `Sat Dec 16 12:55:24 GMT 2023`
Record UNII	Q5YGX5BNW5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3'-NITRO-4'-METHYLACETOPHENONE

Systematic Name

English

4'-METHYL-3'-NITROACETOPHENONE

Systematic Name

English

1-(4-METHYL-3-NITROPHENYL)ETHANONE

Systematic Name

English

1-(4-METHYL-3-NITROPHENYL)ETHAN-1-ONE

Systematic Name

English

NSC-617

Code

English

ETHANONE, 1-(4-METHYL-3-NITROPHENYL)-

Systematic Name

English

Code System Code Type Description

NSC

617

Created by admin on Sat Dec 16 12:55:24 GMT 2023 , Edited by admin on Sat Dec 16 12:55:24 GMT 2023

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FDA UNII

Q5YGX5BNW5

Created by admin on Sat Dec 16 12:55:24 GMT 2023 , Edited by admin on Sat Dec 16 12:55:24 GMT 2023

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EPA CompTox

DTXSID9063790

Created by admin on Sat Dec 16 12:55:24 GMT 2023 , Edited by admin on Sat Dec 16 12:55:24 GMT 2023

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CAS

5333-27-7

Created by admin on Sat Dec 16 12:55:24 GMT 2023 , Edited by admin on Sat Dec 16 12:55:24 GMT 2023

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PUBCHEM

79246

Created by admin on Sat Dec 16 12:55:24 GMT 2023 , Edited by admin on Sat Dec 16 12:55:24 GMT 2023

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