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1-Naphthalenesulfonicacid, 3-hydroxy-4-[2-(1-hydroxy-2-naphthalenyl)diazenyl]-7-nitro-, sodium salt(1:1) (1787-61-7)

Identification
Name:1-Naphthalenesulfonicacid, 3-hydroxy-4-[2-(1-hydroxy-2-naphthalenyl)diazenyl]-7-nitro-, sodium salt(1:1)
Synonyms:Chromogene Black ET (6CI);Acid Chrome Black ET;Acid Chrome Black Special;Acid Mordant Black T;Alizarine Chrome Black PT;DiamondBlack PT;Durochrome Black T;Eniacromo Black PA;Eriochrome Black TDW;Fast Chrome Black T;FenakromBlack ET;Kenachrome Black T;Magracrom Black A;
CAS:1787-61-7
EINECS: 217-250-3
Molecular Formula: C20H13N3O7S. Na
Molecular Weight: 461.38
InChI: InChI=1/C20H13N3O7S.Na/c24-17-10-18(31(28,29)30)15-9-12(23(26)27)6-7-14(15)19(17)22-21-16-8-5-11-3-1-2-4-13(11)20(16)25;/h1-10,24-25H,(H,28,29,30);/q;+1/p-1/b22-21+;
Molecular Structure: (C20H13N3O7S.Na) Chromogene Black ET (6CI);Acid Chrome Black ET;Acid Chrome Black Special;Acid Mordant Black T;Alizar...
Properties
Transport:UN 1230
Flash Point: °C
Boiling Point: °Cat760mmHg
Density:g/cm3
Stability:Stable. Incompatible with strong oxidizing agents, strong reducing agents.
Solubility:50 g/L (20 oC)
Appearance:black powder
Specification:

The Eriochrome black T, with the?CAS registry number 1787-61-7, has the IUPAC name of (4Z)-4-[(1-hydroxynaphthalen-2-yl)hydrazinylidene]-7-nitro-3-oxonaphthalene-1-sulfonic acidis. For being a kind of black powder, this is soluble in water while slightly soluble in alcohol and acetone, and it is stable chemically but incompatible with strong oxidizing agents, strong reducing agents. Besides, its product categories are including Dyes and Pigments; Analytical Chemistry; Azo Compounds; Chelating Reagents; Naphthylazo Compounds.

The characteristics of this chemical are as follows: (1)#H bond acceptors: 10; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 176.58; (5)Exact Mass: 439.04742; (6)MonoIsotopic Mass: 439.04742; (7)Topological Polar Surface Area: 170; (8)Heavy Atom Count: 31; (9)Complexity: 905; (10)Covalently-Bonded Unit Count: 1.

When you are dealing with this chemical, you should be very cautious. For being a kind of irritant chemical, it is irritating to eyes, respiratory system and skin and may cause inflammation to the skin or other mucous membranes. Therefore, you should take the following instructions to protect youself.?Wear suitable gloves and eye/face protection. And if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice

As to its usage, it is widely applied in many ways. It could be used in dyeing and printing of wool fabric and also in dyeing of silk and nylon; Then it could be used in the leather dyeing. In addition, it could then be used in dyeing of wool top, knitting wool, and all other textiles.

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C=CC(=C2O)NN=C3C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)O
(2)Isomeric SMILES: C1=CC=C2C(=C1)C=CC(=C2O)N/N=C\3/C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)O
(3)InChI: InChI=1S/C20H13N3O7S/c24-17-10-18(31(28,29)30)15-9-12(23(26)27)6-7-14(15)19(17)22-21-16-8-5-11-3-1-2-4-13(11)20(16)25/h1-10,21,25H,(H,28,29,30)/b22-19-
(4)InChIKey: HXCVORTXAHFAHC-QOCHGBHMSA-N?

Below are the toxicity information of this chemical:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 17590mg/kg (17590mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Bromatologia i Chemia Toksykologiczna. Vol. 21, Pg. 65, 1988.

HS Code: 32041900
Flash Point: °C
Storage Temperature: Store at RT.
Usage:

To dye wool from an acid bath reddish-black, which can be converted to blue-black by afterchroming.

Safety Data
Hazard Symbols Xi:Irritant
 

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