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CAS No.: | 51850-95-4 |
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Name: | 2,4-Dichloro-N-[(2,4-dichlorophenyl)methyl]-N-hydroxybenzenemethanamine |
Molecular Structure: | |
Formula: | C14H11Cl4NO |
Molecular Weight: | 351.06 |
Synonyms: | N,N-bis[(2,4-dichlorophenyl)methyl]hydroxylamine;Benzenemethanamine, 2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N-hydroxy-; |
Density: | 1.491 g/cm3 |
Boiling Point: | 482.276 °C at 760 mmHg |
Flash Point: | 245.472 °C |
PSA: | 23.47000 |
LogP: | 5.69160 |
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The 2,4-Dichloro-N-[(2,4-dichlorophenyl)methyl]-N-hydroxybenzenemethanamine, with the CAS registry number 51850-95-4, is also known as Benzenemethanamine, 2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N-hydroxy-. This chemical's molecular formula is C14H11Cl4NO and molecular weight is 351.06. What's more, its systematic name is N,N-bis[(2,4-dichlorophenyl)methyl]hydroxylamine.
Physical properties of 2,4-Dichloro-N-[(2,4-dichlorophenyl)methyl]-N-hydroxybenzenemethanamine are: (1)ACD/LogP: 4.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.76; (4)ACD/LogD (pH 7.4): 4.76; (5)ACD/BCF (pH 5.5): 2442.32; (6)ACD/BCF (pH 7.4): 2442.51; (7)ACD/KOC (pH 5.5): 9258.94; (8)ACD/KOC (pH 7.4): 9259.66; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 23.47 Å2; (13)Index of Refraction: 1.643; (14)Molar Refractivity: 85.126 cm3; (15)Molar Volume: 235.514 cm3; (16)Polarizability: 33.747×10-24cm3; (17)Surface Tension: 55.19 dyne/cm; (18)Density: 1.491 g/cm3; (19)Flash Point: 245.472 °C; (20)Enthalpy of Vaporization: 78.699 kJ/mol; (21)Boiling Point: 482.276 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(Cl)ccc2CN(O)Cc1ccc(Cl)cc1Cl
(2)Std. InChI: InChI=1S/C14H11Cl4NO/c15-11-3-1-9(13(17)5-11)7-19(20)8-10-2-4-12(16)6-14(10)18/h1-6,20H,7-8H2
(3)Std. InChIKey: UCOJEGLSMUGXIF-UHFFFAOYSA-N