4-Methoxy-3-nitrobenzenesulfonyl chloride

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H6ClNO5S
Molecular Weight	251.644
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Methoxy-3-nitrobenzenesulfonyl chloride

Structure Search

SMILES

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

InChI

InChIKey=PWYNJONRUFAOFG-UHFFFAOYSA-N

InChI=1S/C7H6ClNO5S/c1-14-7-3-2-5(15(8,12)13)4-6(7)9(10)11/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H6ClNO5S
Molecular Weight	251.644
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 `Wed Apr 02 19:30:56 GMT 2025` Edited by `admin` on `Wed Apr 02 19:30:56 GMT 2025`
Record UNII	KE2UJU7MJJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzenesulfonyl chloride, 4-methoxy-3-nitro-

Preferred Name

English

4-Methoxy-3-nitrobenzenesulfonyl chloride

Systematic Name

English

2-Nitroanisole-4-sulfonyl chloride

Systematic Name

English

Code System Code Type Description

FDA UNII

KE2UJU7MJJ

Created by admin on Wed Apr 02 19:30:56 GMT 2025 , Edited by admin on Wed Apr 02 19:30:56 GMT 2025

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CAS

22117-79-9

Created by admin on Wed Apr 02 19:30:56 GMT 2025 , Edited by admin on Wed Apr 02 19:30:56 GMT 2025

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ECHA (EC/EINECS)

244-788-6

Created by admin on Wed Apr 02 19:30:56 GMT 2025 , Edited by admin on Wed Apr 02 19:30:56 GMT 2025

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PUBCHEM

89600

Created by admin on Wed Apr 02 19:30:56 GMT 2025 , Edited by admin on Wed Apr 02 19:30:56 GMT 2025

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EPA CompTox

DTXSID8066761

Created by admin on Wed Apr 02 19:30:56 GMT 2025 , Edited by admin on Wed Apr 02 19:30:56 GMT 2025

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