Structure

Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate

CAS
94166-73-1
Catalog Number
ACM94166731
Category
Other Products
Molecular Weight
363.751910 [g/mol]
Molecular Formula
C13H12ClN3O4SNa

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Specification

Synonyms
EINECS 303-370-4, CID5744302, Sodium 5-((4-amino-5-hydroxy-o-tolyl)azo)-2-chlorobenzenesulphonate, 94166-73-1
IUPAC Name
sodium 2-chloro-5-[2-(4-imino-6-methyl-3-oxocyclohexa-1,5-dien-1-yl)hydrazinyl]benzenesulfonate
SMILES
CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)Cl)S(=O)(=O)O)[O-])N.[Na+]
InChI Key
LVVRUVSHGKUCQM-UHFFFAOYSA-M
EC Number
303-370-4
Exact Mass
363.00600
H-Bond Acceptor
7
H-Bond Donor
3
What is the molecular formula of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The molecular formula is C13H11ClN3NaO4S.

What is the molecular weight of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The molecular weight is 363.75 g/mol.

What are the synonyms for Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

EINECS 303-370-4, 94166-73-1, Sodium 5-((4-amino-5-hydroxy-o-tolyl)azo)-2-chlorobenzenesulphonate, DTXSID20916210.

When was Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate created and modified?

It was created on January 17, 2019, and modified on December 30, 2023.

What are the components compounds of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The component compounds are CID 3023924 (5-((4-Amino-5-hydroxy-o-tolyl)azo)-2-chlorobenzenesulphonic acid) and CID 5360545 (Sodium).

What is the IUPAC name of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The IUPAC name is sodium;5-[(4-amino-5-hydroxy-2-methylphenyl)diazenyl]-2-chlorobenzenesulfonate.

What is the Canonical SMILES representation of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The Canonical SMILES representation is CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)Cl)S(=O)(=O)[O-])O)N.[Na+].

What is the InChIKey of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The InChIKey is UPGFSXRNCUHGBM-UHFFFAOYSA-M.

What is the Topological Polar Surface Area of Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate?

The Topological Polar Surface Area is 137 Ų.

Is Sodium 5-[(4-amino-5-hydroxy-O-tolyl)azo]-2-chlorobenzenesulfonate considered canonicalized?

Yes, it is considered canonicalized.

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