Product Name

  • Name

    Disperse Orange 30

  • EINECS 226-070-4
  • CAS No. 12223-23-3
  • Article Data7
  • CAS DataBase
  • Density 1.38 g/cm3
  • Solubility
  • Melting Point
  • Formula C19H17Cl2N5O4
  • Boiling Point 645 °C at 760 mmHg
  • Molecular Weight 450.281
  • Flash Point 343.9 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 12223-23-3 (Disperse Orange 30)
  • Hazard Symbols
  • Synonyms 4-((2,6-Dichloro-4-nitrophenyl)azo)-N-(cyanoethyl)-N-(acetoxyethyl)aniline;2-(N-(2-Cyanoethyl)-4-((2,6-dichloro-4-nitrophenyl)azo)anilino)ethyl acetate;
  • PSA 123.87000
  • LogP 6.12338

Disperse Orange 30 Specification

The Disperse Orange 30, with CAS registry number 12223-23-3, belongs to the following product category: Dyes and Pigments. It has the systematic name of 2-[(2-cyanoethyl){4-[(E)-(2,6-dichloro-4-nitrophenyl)diazenyl]phenyl}amino]ethyl acetate. And the chemical formula of this chemical is  C19H17Cl2N5O4. The main use of this chemical is for the dyeing of polyester fabric and its blending. And it is also used for dyeing of acetate fiber and polyamide fiber.

Physical properties of Disperse Orange 30: (1)ACD/LogP: 5.39; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.39; (4)ACD/LogD (pH 7.4): 5.39; (5)ACD/BCF (pH 5.5): 7355.31; (6)ACD/BCF (pH 7.4): 7355.37; (7)ACD/KOC (pH 5.5): 20384.63; (8)ACD/KOC (pH 7.4): 20384.81; (9)#H bond acceptors: 9; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 123.87 Å2; (13)Index of Refraction: 1.618; (14)Molar Refractivity: 113.91 cm3; (15)Molar Volume: 325.1 cm3; (16)Polarizability: 45.15×10-24cm3; (17)Surface Tension: 53.5 dyne/cm; (18)Enthalpy of Vaporization: 95.15 kJ/mol; (19)Vapour Pressure: 1.59E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(cc(Cl)c2/N=N/c1ccc(N(CCC#N)CCOC(=O)C)cc1)[N+]([O-])=O
(2)InChI: InChI=1/C19H17Cl2N5O4/c1-13(27)30-10-9-25(8-2-7-22)15-5-3-14(4-6-15)23-24-19-17(20)11-16(26(28)29)12-18(19)21/h3-6,11-12H,2,8-10H2,1H3/b24-23+
(3)InChIKey: ROPYWXVRNREIQD-WCWDXBQEBN
(4)Std. InChI: InChI=1S/C19H17Cl2N5O4/c1-13(27)30-10-9-25(8-2-7-22)15-5-3-14(4-6-15)23-24-19-17(20)11-16(26(28)29)12-18(19)21/h3-6,11-12H,2,8-10H2,1H3/b24-23+
(5)Std. InChIKey: ROPYWXVRNREIQD-WCWDXBQESA-N

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