CAS No.4553-89-3,disodium 4,4'-[[2,4-dihydroxy-5-(hydroxymethyl)-1,3-phenylene]bis(azo)]bisnaphthalene-1-sulphonate Suppliers

Products Categories

Pharmaceutical (33)
Others (22)
Organic Chemicals (3)
Basic Inorganic Chemicals (2)
Materials (1)
Food Additives (1)

Basic Information

Molecular Structure:
CAS No.:	4553-89-3
Name:	disodium 4,4'-[[2,4-dihydroxy-5-(hydroxymethyl)-1,3-phenylene]bis(azo)]bisnaphthalene-1-sulphonate

Formula:	C₂₇H₂₀N₄O₉S₂.2Na
Molecular Weight:	652.56300
Synonyms:	1-Naphthalenesulfonicacid, 4,4'-[[2,4-dihydroxy-5-(hydroxymethyl)-1,3-phenylene]bis(azo)]bis-,disodium salt (9CI);C.I. Food Brown 3, disodium salt(8CI);Brown HT;Edicol Brown HT;Hexacol Chocolate Brown HT;
EINECS:	224-924-0
Density:	0.816[at 20℃]
Solubility:	99.418g/L at 25℃
PSA:	241.29000
LogP:	7.69710

Total:59 Page 1 of 2 1 2 Next>>

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 4553-89-3

Chemistry

Molecular Formula: C₂₇H₁₈N₄Na₂O₉S₂
Molar mass: 652.56276 g/mol
EINECS: 224-924-0
Appearance: Brown powder or granules
Solubility: Soluble in water, Not soluble in ethanol
Structure of C.I. Food Brown 3, disodium salt (4553-89-3):

H-Bond Donor: 3
H-Bond Acceptor: 13
IUPAC Name: Disodium
4-[(2E)-2-[(5E)-3-(hydroxymethyl)-2,
6-dioxo-5-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]cyclohex-3-en-1-
ylidene]hydrazinyl]naphthalene-1-sulfonate
Canonical SMILES: C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])NN=C3C=C(C(=O)C(=NNC4=CC=C(C5=CC=CC=
C54)S(=O)(=O)[O-])C3=O)CO.[Na+].[Na+]
Isomeric SMILES: C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C/3\C=C(C(=O)/C(=N\NC4=CC=C(C5=
CC=CC=C54)S(=O)(=O)[O-])/C3=O)CO.[Na+].[Na+]
InChI: InChI=1S/C27H20N4O9S2.2Na/c32-14-15-13-22(30-28-20-9-11-23(41(35,
36)37)18-7-3-1-5-16(18)20)27(34)25(26(15)33)31-29-21-10-12-24(42(38,
39)40)19-8-4-2-6-17(19)21;;/h1-13,28-29,32H,14H2,(H,35,36,37)(H,38,39,
40);;/q;2*+1/p-2/b30-22+,31-25+;;
InChIKey: TUQJHVRCALPCHU-CRVUNLCOSA-L

Uses

C.I. Food Brown 3, disodium salt (4553-89-3) can be used of edible brown pigment.

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	220mg/kg (220mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: COMA	Food and Cosmetics Toxicology. Vol. 4, Pg. 143, 1966.
mouse	LD50	oral	> 2gm/kg (2000mg/kg)		Food and Cosmetics Toxicology. Vol. 4, Pg. 143, 1966.
rat	LD50	intraperitoneal	375mg/kg (375mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: COMA	Food and Cosmetics Toxicology. Vol. 4, Pg. 143, 1966.
rat	LD50	oral	> 2gm/kg (2000mg/kg)		Food and Cosmetics Toxicology. Vol. 4, Pg. 143, 1966.

Safety Profile

Poison by intraperitoneal route. When heated to decomposition it emits very toxic fumes of NO_x, Na₂O, and SO_x.

Specification

C.I. Food Brown 3, disodium salt (4553-89-3) also can be called Hned potravinarska 3 [Czech] ; C.I. Food Brown 3 ; Certicol Brown N Extra ; Brown HT ; Hexacol Brown HT ; Hned potravinarska 3 .