3-Methyl-1-(4-nitrophenyl)-5-pyrazolone

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H9N3O3
Molecular Weight	219.1968
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Methyl-1-(4-nitrophenyl)-5-pyrazolone

Structure Search

SMILES

CC1=NN(C(=O)C1)C2=CC=C(C=C2)[N+]([O-])=O

InChI

InChIKey=MYPAMGFTHVEING-UHFFFAOYSA-N

InChI=1S/C10H9N3O3/c1-7-6-10(14)12(11-7)8-2-4-9(5-3-8)13(15)16/h2-5H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H9N3O3
Molecular Weight	219.1968
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 20:29:13 GMT 2025` Edited by `admin` on `Tue Apr 01 20:29:13 GMT 2025`
Record UNII	B9SDZ9U3E8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-15353

Preferred Name

English

3-Methyl-1-(4-nitrophenyl)-5-pyrazolone

Systematic Name

English

AI3-61060

Code

English

2-Pyrazolin-5-one, 3-methyl-1-(p-nitrophenyl)-

Systematic Name

English

3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-2-(4-nitrophenyl)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

80816

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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FDA UNII

B9SDZ9U3E8

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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NSC

15353

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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EPA CompTox

DTXSID7064312

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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CAS

6402-09-1

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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ECHA (EC/EINECS)

229-018-9

Created by admin on Tue Apr 01 20:29:13 GMT 2025 , Edited by admin on Tue Apr 01 20:29:13 GMT 2025

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