CAS No.124691-76-5,5,6-DICHLORO-1H-INDAZOLE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	124691-76-5
Name:	5,6-DICHLORO-1H-INDAZOLE
Article Data:	2

Formula:	C₇H₄Cl₂N2
Molecular Weight:	187.03
Synonyms:	NSC 38855;
Density:	1.572 g/cm³
Melting Point:	204 °C
Boiling Point:	347.308 °C at 760 mmHg
Flash Point:	194.698 °C
PSA:	28.68000
LogP:	2.86970

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Specification

5,6-Dichloroindazole, with the CAS registry number 124691-76-5, is also named as 1H-Indazole, 5,6-dichloro-. This chemical's molecular formula is C₇H₄Cl₂N2 and molecular weight is 187.03. What's more, its systematic name is 5,6-Dichloro-1H-indazole.

Physical properties of 5,6-Dichloroindazole are: (1)ACD/LogP: 3.108; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.11; (4)ACD/LogD (pH 7.4): 3.11; (5)ACD/BCF (pH 5.5): 135.62; (6)ACD/BCF (pH 7.4): 135.62; (7)ACD/KOC (pH 5.5): 1169.32; (8)ACD/KOC (pH 7.4): 1169.25; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.68 Å²; (13)Index of Refraction: 1.708; (14)Molar Refractivity: 46.41 cm³; (15)Molar Volume: 118.997 cm³; (16)Polarizability: 18.398×10^-24cm³; (17)Surface Tension: 64.02 dyne/cm; (18)Density: 1.572 g/cm³; (19)Flash Point: 194.698 °C; (20)Enthalpy of Vaporization: 56.819 kJ/mol; (21)Boiling Point: 347.308 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc2c(cc1Cl)nnc2
(2)Std. InChI: InChI=1S/C7H4Cl2N2/c8-5-1-4-3-10-11-7(4)2-6(5)9/h1-3H,(H,10,11)
(3)Std. InChIKey: MCHJBZZQBWIBOK-UHFFFAOYSA-N