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82674-17-7

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Basic Information
CAS No.: 82674-17-7
Name: 4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine
Molecular Structure:
Molecular Structure of 82674-17-7 (4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine)
Formula: C12H11ClN2O
Molecular Weight: 234.6815
Density: 1.292 g/cm3
Boiling Point: 418.2 °C at 760 mmHg
Flash Point: 206.7 °C
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  • 4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine CAS 82674-17-7

  • Casno:

    82674-17-7

    4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine CAS 82674-17-7

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  • 4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine

  • Casno:

    82674-17-7

    4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine

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Specification

The 4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine is an organic compound with the formula C12H11ClN2O. With the CAS registry number 82674-17-7, the systematic name of this chemical is 4-[(6-chloropyridin-3-yl)methoxy]aniline.

Physical properties about 4-(6-Chloro-pyridin-3-ylmethoxy)-phenylamine are: (1)ACD/LogP: 1.58; (2)ACD/LogD (pH 5.5): 1.47; (3)ACD/LogD (pH 7.4): 1.58; (4)ACD/BCF (pH 5.5): 7.23; (5)ACD/BCF (pH 7.4): 9.29; (6)ACD/KOC (pH 5.5): 133.36; (7)ACD/KOC (pH 7.4): 171.48; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 48.14 Å2; (12)Index of Refraction: 1.63; (13)Molar Refractivity: 64.64 cm3; (14)Molar Volume: 181.5 cm3; (15)Polarizability: 25.62×10-24cm3; (16)Surface Tension: 53.8 dyne/cm; (17)Density: 1.292 g/cm3; (18)Flash Point: 206.7 °C; (19)Enthalpy of Vaporization: 67.17 kJ/mol; (20)Boiling Point: 418.2 °C at 760 mmHg; (21)Vapour Pressure: 3.35E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(COc1ccc(N)cc1)cn2
(2)InChI: InChI=1/C12H11ClN2O/c13-12-6-1-9(7-15-12)8-16-11-4-2-10(14)3-5-11/h1-7H,8,14H2
(3)InChIKey: NLYRPELHYCCULX-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C12H11ClN2O/c13-12-6-1-9(7-15-12)8-16-11-4-2-10(14)3-5-11/h1-7H,8,14H2
(5)Std. InChIKey: NLYRPELHYCCULX-UHFFFAOYSA-N