RED 10B

General Information

Synonyms:	CI FOOD RED 12, D AND C RED No. 33, FAST ACID FUCHSINE B, FAST ACID MAGENTA B, NAPHTALENE RED B
Chemical Names:	DISODIUM SALT OF 5-AMINO-4-HYDROXY-3-(PHENYLAZO)-2,7-NAPHTHALENEDISULFONIC ACID
CAS number:	3567-66-6
Functional Class:	Food Additives COLOUR

From apps.who.int

Evaluations

Evaluation year:	1964
Meeting:	28
Specs Code:	W
Report:	NMRS 38/TRS 309-JECFA 8/23
Specification:	WITHDRAWN (1984)

From apps.who.int

Computed Descriptors

2D Structure
CID	5359892
IUPAC Name	disodium;(3Z)-5-amino-4-oxo-3-(phenylhydrazinylidene)naphthalene-2,7-disulfonate
InChI	InChI=1S/C16H13N3O7S2.2Na/c17-12-8-11(27(21,22)23)6-9-7-13(28(24,25)26)15(16(20)14(9)12)19-18-10-4-2-1-3-5-10;;/h1-8,18H,17H2,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b19-15+;;
InChI Key	HZYOIDDAGQUYLF-WTBAQZMLSA-L
Canonical SMILES	C1=CC=C(C=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
Molecular Formula	C16H11N3Na2O7S2
Wikipedia	D&C Red 33

From Pubchem

Computed Properties

Property Name	Property Value
Molecular Weight	467.378
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	2
Complexity	867.0
CACTVS Substructure Key Fingerprint	A A A D c c B 7 O D B g A A A A A A A A A A A A A A A A A A A A A A A w Y I A A A A A A A A C B Q A A A H g Q Y A A A A D A y B 2 A A w w Y B i A A K o A 6 R y Q H D S B E A k A g A Y i B k g Z N g I I D q A l Z G A I Y R g m A A I y U c Y i I C O k A A A w C A S A A A g A A G A Q C Q A A A A A A A A A A A = =
Topological Polar Surface Area	199.0
Monoisotopic Mass	466.983
Exact Mass	466.983
Compound Is Canonicalized	True
Formal Charge	0
Heavy Atom Count	30
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Isotope Atom Count	0
Covalently-Bonded Unit Count	3

From Pubchem

Taxonomic Classification

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Naphthalenes
Alternative Parents	Sulfonyls Organic cations Vinylogous amides Hydrocarbon derivatives Aryl ketones Organic oxides Organic sodium salts Hydrazones Primary amines Organosulfonic acids Phenylhydrazines
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Naphthalene - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenylhydrazine - Aryl ketone - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Vinylogous amide - Ketone - Organic alkali metal salt - Hydrazone - Organic oxygen compound - Organic nitrogen compound - Amine - Primary amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic sodium salt - Organic salt - Organic cation - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.

From ClassyFire