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Basic Violet 1

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Name

Basic Violet 1

EINECS 210-042-3
CAS No. 8004-87-3 Density 1.089g/cm3
PSA 20.45000 LogP -0.09810
Solubility soluble in water Melting Point 137 °C
Formula C24H28ClN3 Boiling Point 532.2 °C at 760 mmHg
Molecular Weight 393.96 Flash Point 275.7 °C
Transport Information N/A Appearance green crystalline powder with metal lustre
Safety 26-36-24/25-22 Risk Codes 22-36
Molecular Structure Molecular Structure of 8004-87-3 (Basic Violet 1) Hazard Symbols HarmfulXn
Synonyms

Methylviolet (6CI);Aizen Methyl Violet BB;Aizen Methyl Violet Pure Special;BasicViolet 1;Basic Violet K;Basonyl Violet 600;C Ext. Violet5;C.I. 42535;Dahlia Michrome 105;Methyl Violet 2B;MethylViolet 6B;Methyl Violet B;Methyl Violet BB;Methyl Violet FN;Methyl VioletN;Methyl Violet PSL;Methyl Violet Pure Special;Methyl Violet pure SP;ParisViolet R;Pyoktanin blue;Pyoktaninum coeruleum;Violet Powder H 2503;C.I. Basic Violet 1;

 

Basic Violet 1 Consensus Reports

EPA Genetic Toxicology Program. Reported in EPA TSCA Inventory.

Basic Violet 1 Specification

The IUPAC name of Methyl Violet BB is 4-[(4-dimethylaminophenyl)-(4-methyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N,N-dimethylaniline hydrochloride . With the CAS registry number 8004-87-3, it is also named as Aizen Methyl Violet ; Basic Violet 1 ; Basic Violet K ; Basonyl Violet 600 ; C Ext. Violet 5 ; Methyl Violet FN ; Pyoktanin Blue ; Pyoktaninum coeruleum ; Benzenamine, 4,4'-[[4-(methylimino)-2,5-cyclohexadien-1-ylidene]methylene]bis[N,N-dimethyl-, hydrochloride (1:1) .

The Methyl Violet BB is green crystalline powder with metal lustre. It is soluble in water. The product's categories are analytical chemistry, pH indicators, analytical reagents, microscopy reagents and stains and dyes. It is atable under normal temperatures and pressures. When heated to decomposition it emits acrid smoke and irritating fumes. This product is used as a biological stain. 

The Methyl Violet BB is harmful if swallowed. It is very toxic by inhalation. So people should not breathe dust and must avoid contact with skin and eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 5.73 ; (2)# of Rule of 5 Violations: 1 ; (3)#H bond acceptors: 3 ; (4)#H bond donors: 0 ; (5)#Freely Rotating Bonds: 4 ; (6)Enthalpy of Vaporization: 80.79 kJ/mol ; (7)Vapour Pressure: 2.08E-11 mmHg at 25°C ; (8)Rotatable Bond Count: 4 ; (9)Exact Mass: 393.197176 ; (10)MonoIsotopic Mass: 393.197176 ; (11)Topological Polar Surface Area: 18.8 ; (12)Heavy Atom Count: 28 ; (13)Complexity: 560.

People can use the following data to convert to the molecule structure. SMILES: Cl.N(=C3\C=C/C(=C(/c1ccc(N(C)C)cc1)c2ccc(N(C)C)cc2)/C=C3)\C; InChI:InChI=1/C24H27N3.ClH/c1-25-21-12-6-18(7-13-21)24(19-8-14-22(15-9-19)26(2)3)20-10-16-23(17-11-20)27(4)5;/h6-17H,1-5H3;1H.

The following is the toxicity data which has been tested.

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 6mg/kg (6mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 1, Pg. 5, 1951.
mouse LD50 oral 105mg/kg (105mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 1, Pg. 5, 1951.
rat LD50 oral 413mg/kg (413mg/kg)   United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0382-0436,
rat LD50 unreported 975mg/kg (975mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 43(4), Pg. 102, 1978.

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