Benzene,2,4-dichloro-1-[(4-chlorophenyl)thio]- supplier

Name
BENZENE,2,4-DICHLORO-1-[(4-CH
EINECS
CAS No. 55759-88-1
Density 1.46 g/cm³
Solubility
Melting Point
Formula C₁₂H₇Cl₃S
Boiling Point 375.1 °C at 760 mmHg
Molecular Weight 289.6080
Flash Point 168.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,4-Dichloro-1-[(4-chlorophenyl)thio]benzene;
PSA 25.30000
LogP 5.79800

Benzene,2,4-dichloro-1-[(4-chlorophenyl)thio]- Specification

The Benzene, 2, 4-dichloro-1-[(4-chlorophenyl)thio]-, with the CAS registry number 55759-88-1, is also known as 2, 4-Dichloro-1-[(4-chlorophenyl)thio]benzene. This chemical's molecular formula is C₁₂H₇Cl₃S and molecular weight is 289.6080. What's more, its IUPAC name is 2, 4-Dichloro-1-(4-chlorophenyl)sulfanylbenzene.

Physical properties about Benzene, 2, 4-dichloro-1-[(4-chlorophenyl)thio]- are: (1)ACD/LogP: 6.89; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.89; (4)ACD/LogD (pH 7.4): 6.89; (5)ACD/BCF (pH 5.5): 101591.84; (6)ACD/BCF (pH 7.4): 101591.84; (7)ACD/KOC (pH 5.5): 133502.3; (8)ACD/KOC (pH 7.4): 133502.3; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 25.3 Å²; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 73.95 cm³; (15)Molar Volume: 197.7 cm³; (16)Polarizability: 29.31×10^-24 cm³; (17)Surface Tension: 56.1 dyne/cm; (18)Density: 1.46 g/cm³; (19)Flash Point: 168.8 °C; (20)Enthalpy of Vaporization: 59.81 kJ/mol; (21)Boiling Point: 375.1 °C at 760 mmHg; (22)Vapour Pressure: 1.72E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2cc(Cl)ccc2Sc1ccc(Cl)cc1
(2) InChI: InChI=1/C12H7Cl3S/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H
(3) InChIKey: VEJJRNAKABCDJC-UHFFFAOYAZ

Product Name

BENZENE,2,4-DICHLORO-1-[(4-CH

Benzene,2,4-dichloro-1-[(4-chlorophenyl)thio]- Specification

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