5-NITRO-O-TOLUENESULFONIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H7NO5S
Molecular Weight	217.199
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-NITRO-O-TOLUENESULFONIC ACID

Structure Search

SMILES

CC1=C(C=C(C=C1)[N+]([O-])=O)S(O)(=O)=O

InChI

InChIKey=ZDTXQHVBLWYPHS-UHFFFAOYSA-N

InChI=1S/C7H7NO5S/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13/h2-4H,1H3,(H,11,12,13)

HIDE SMILES / InChI

Molecular Formula	C7H7NO5S
Molecular Weight	217.199
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:53:20 GMT 2023` Edited by `admin` on `Sat Dec 16 08:53:20 GMT 2023`
Record UNII	JBO1Z0PMOH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-NITRO-O-TOLUENESULFONIC ACID

Common Name

English

2-METHYL-5-NITROBENZENESULFONIC ACID [HSDB]

Common Name

English

P-NITROTOLUENE-O-SULFONIC ACID

Common Name

English

2-TOLUENESULFONIC ACID, 5-NITRO-

Systematic Name

English

BENZENESULFONIC ACID, 2-METHYL-5-NITRO-

Systematic Name

English

5-NITRO-2-METHYLBENZENESULFONIC ACID

Systematic Name

English

NSC-9580

Code

English

O-TOLUENESULFONIC ACID, 5-NITRO-

Systematic Name

English

2-METHYL-5-NITROBENZENESULFONIC ACID

Systematic Name

English

4-NITROTOLUENE-2-SULPHONIC ACID

Systematic Name

English

4-NITROTOLUENE-2-SULFONIC ACID

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

204-445-3