2,4-Dihydro-2-[4-[(2-hydroxyethyl)sulfonyl]phenyl]-5-methyl-3H-pyrazol-3-one

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14N2O4S
Molecular Weight	282.316
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4-Dihydro-2-[4-[(2-hydroxyethyl)sulfonyl]phenyl]-5-methyl-3H-pyrazol-3-one

Structure Search

SMILES

CC1=NN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)CCO

InChI

InChIKey=HYQYPARBQHUKAB-UHFFFAOYSA-N

InChI=1S/C12H14N2O4S/c1-9-8-12(16)14(13-9)10-2-4-11(5-3-10)19(17,18)7-6-15/h2-5,15H,6-8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H14N2O4S
Molecular Weight	282.316
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 19:06:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:06:05 GMT 2025`
Record UNII	A837J8M5FP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4-Dihydro-2-[4-[(2-hydroxyethyl)sulfonyl]phenyl]-5-methyl-3H-pyrazol-3-one

Systematic Name

English

3H-Pyrazol-3-one, 2,4-dihydro-2-[4-[(2-hydroxyethyl)sulfonyl]phenyl]-5-methyl-

Preferred Name

English

Code System Code Type Description

EPA CompTox

DTXSID0066743

Created by admin on Tue Apr 01 19:06:05 GMT 2025 , Edited by admin on Tue Apr 01 19:06:05 GMT 2025

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FDA UNII

A837J8M5FP

Created by admin on Tue Apr 01 19:06:05 GMT 2025 , Edited by admin on Tue Apr 01 19:06:05 GMT 2025

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CAS

21951-34-8

Created by admin on Tue Apr 01 19:06:05 GMT 2025 , Edited by admin on Tue Apr 01 19:06:05 GMT 2025

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ECHA (EC/EINECS)

244-678-8

Created by admin on Tue Apr 01 19:06:05 GMT 2025 , Edited by admin on Tue Apr 01 19:06:05 GMT 2025

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PUBCHEM

89114

Created by admin on Tue Apr 01 19:06:05 GMT 2025 , Edited by admin on Tue Apr 01 19:06:05 GMT 2025

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