3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine supplier

Name
3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine
EINECS
CAS No. 1039922-08-1
Density 1.425g/cm³
Solubility
Melting Point
Formula C₁₃H₁₀Cl₃NO
Boiling Point 445.185 °C at 760 mmHg
Molecular Weight 302.58
Flash Point 223.04 °C
Transport Information
Appearance Kind of white to yellow powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Chloro-4-[1,1,2-trifluoro-2-(trifluoromethoxy)ethoxy]benzenamine
PSA 35.25000
LogP 5.38920

3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine Specification

The 3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine with cas registry number of 1039922-08-1, whose systematic name is 3-chloro-4-[(3,4-dichlorophenyl)methoxy]aniline.

Physical properties about this chemical are: (1)ACD/LogP: 4.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.103; (4)ACD/LogD (pH 7.4): 4.114; (5)ACD/BCF (pH 5.5): 768.354; (6)ACD/BCF (pH 7.4): 788.461; (7)ACD/KOC (pH 5.5): 4016.577; (8)ACD/KOC (pH 7.4): 4121.69; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 35.25 Å²; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 76.34 cm³; (15)Molar Volume: 212.27 cm³; (16)Polarizability: 30.264 10^-24cm³; (17)Surface Tension: 51.822 dyne/cm; (18)Enthalpy of Vaporization: 70.313 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:c1cc(c(cc1COc2ccc(cc2Cl)N)Cl)Cl;
(2)InChI:InChI=1/C13H10Cl3NO/c14-10-3-1-8(5-11(10)15)7-18-13-4-2-9(17)6-12(13)16/h1-6H,7,17H2;
(3)InChIKey:DDVAXLBVKMZWAO-UHFFFAOYAX;
(4)Std. InChI:InChI=1S/C13H10Cl3NO/c14-10-3-1-8(5-11(10)15)7-18-13-4-2-9(17)6-12(13)16/h1-6H,7,17H2;
(5)Std. InChIKey:DDVAXLBVKMZWAO-UHFFFAOYSA-N

Product Name

3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine

3-Chloro-4-[(3,4-dichlorophenyl)methoxy]benzenamine Specification

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