5-Amino-4-hydroxytoluene-3-sulfonic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H9NO4S
Molecular Weight	203.216
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Amino-4-hydroxytoluene-3-sulfonic acid

Structure Search

SMILES

CC1=CC(N)=C(O)C(=C1)S(O)(=O)=O

InChI

InChIKey=GXINVVNDQWECJP-UHFFFAOYSA-N

InChI=1S/C7H9NO4S/c1-4-2-5(8)7(9)6(3-4)13(10,11)12/h2-3,9H,8H2,1H3,(H,10,11,12)

HIDE SMILES / InChI

Molecular Formula	C7H9NO4S
Molecular Weight	203.216
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 12:35:57 GMT 2023` Edited by `admin` on `Sat Dec 16 12:35:57 GMT 2023`
Record UNII	G768CJ8V32
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-Amino-4-hydroxytoluene-3-sulfonic acid

Systematic Name

English

3-Amino-2-hydroxy-5-methylbenzenesulfonic acid

Systematic Name

English

Benzenesulfonic acid, 3-amino-2-hydroxy-5-methyl-

Systematic Name

English

Code System Code Type Description

FDA UNII

G768CJ8V32

Created by admin on Sat Dec 16 12:35:57 GMT 2023 , Edited by admin on Sat Dec 16 12:35:57 GMT 2023

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PUBCHEM

80803

Created by admin on Sat Dec 16 12:35:57 GMT 2023 , Edited by admin on Sat Dec 16 12:35:57 GMT 2023

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ECHA (EC/EINECS)

228-990-1

Created by admin on Sat Dec 16 12:35:57 GMT 2023 , Edited by admin on Sat Dec 16 12:35:57 GMT 2023

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EPA CompTox

DTXSID30213383

Created by admin on Sat Dec 16 12:35:57 GMT 2023 , Edited by admin on Sat Dec 16 12:35:57 GMT 2023

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CAS

6387-15-1

Created by admin on Sat Dec 16 12:35:57 GMT 2023 , Edited by admin on Sat Dec 16 12:35:57 GMT 2023

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