CAS No.57103-21-6,3,6-Diiodo-9-phenyl-9H-carbazole Suppliers

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Basic Information

Molecular Structure:
CAS No.:	57103-21-6
Name:	3,6-Diiodo-9-phenyl-9H-carbazole
Article Data:	14

Formula:	C₁₈H₁₁I₂N
Molecular Weight:	495.101
Synonyms:	9H-Carbazole, 3,6-diiodo-9-phenyl-;3,6-Diiodo-9-phenylcarbazole;
Density:	1.947 g/cm³
Melting Point:	181.0 to 185.0 °C
Boiling Point:	540.837 °C at 760 mmHg
Flash Point:	280.888 °C
Appearance:	white to pink yellow powder or crystals
PSA:	4.93000
LogP:	5.99290

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Specification

3,6-Diiodo-9-phenyl-9H-carbazole is an organic compound with the formula C₁₈H₁₁I₂N, and its systematic name is the same with the product name. With the CAS registry number 57103-21-6, it is also named as 9H-Carbazole, 3,6-diiodo-9-phenyl-. In addition, the molecular weight is 495.10.

Physical properties of 3,6-Diiodo-9-phenyl-9H-carbazole are: (1)ACD/LogP: 8.26; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.26; (4)ACD/LogD (pH 7.4): 8.26; (5)ACD/BCF (pH 5.5): 1000000.00; (6)ACD/BCF (pH 7.4): 1000000.00; (7)ACD/KOC (pH 5.5): 742345.30; (8)ACD/KOC (pH 7.4): 742345.30; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 4.93 Å²; (13)Index of Refraction: 1.759; (14)Molar Refractivity: 104.565 cm³; (15)Molar Volume: 254.33 cm³; (16)Polarizability: 41.453×10^-24cm³; (17)Surface Tension: 54.10 dyne/cm; (18)Density: 1.947 g/cm³; (19)Flash Point: 280.888 °C; (20)Enthalpy of Vaporization: 81.858 kJ/mol; (21)Boiling Point: 540.837 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic2cc3c1cc(I)ccc1n(c3cc2)c4ccccc4
(2)Std. InChI: InChI=1S/C18H11I2N/c19-12-6-8-17-15(10-12)16-11-13(20)7-9-18(16)21(17)14-4-2-1-3-5-14/h1-11H
(3)Std. InChIKey: AWGAUYXFWGUFNE-UHFFFAOYSA-N