Pyridazine,3-chloro-6-(1,1-dimethylethyl)- supplier

Name
3-CHLORO-6-(1,1-DIMETHYLETHYL)-PYRIDAZINE
EINECS
CAS No. 41144-46-1
Article Data3
CAS DataBase
Density 1.104 g/cm³
Solubility
Melting Point
Formula C₈H₁₁ClN₂
Boiling Point 270 °C at 760 mmHg
Molecular Weight 170.642
Flash Point 143.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Chloro-6-(1,1-dimethylethyl)pyridazine;3-tert-Butyl-6-chloropyridazine;
PSA 25.78000
LogP 2.42750

Pyridazine,3-chloro-6-(1,1-dimethylethyl)- Specification

The Pyridazine,3-chloro-6-(1,1-dimethylethyl)-, with the CAS registry number 41144-46-1, is also known as 3-Chloro-6-(1,1-dimethylethyl)pyridazine. This chemical's molecular formula is C₈H₁₁ClN₂ and molecular weight is 170.64. What's more, its systematic name is 3-tert-butyl-6-chloropyridazine.

Physical properties of Pyridazine,3-chloro-6-(1,1-dimethylethyl)- are: (1)ACD/LogP: 1.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 13.46; (6)ACD/BCF (pH 7.4): 13.46; (7)ACD/KOC (pH 5.5): 223.79; (8)ACD/KOC (pH 7.4): 223.79; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.78 Å²; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 45.71 cm³; (15)Molar Volume: 154.5 cm³; (16)Polarizability: 18.12×10^-24cm³; (17)Surface Tension: 36.3 dyne/cm; (18)Density: 1.104 g/cm³; (19)Flash Point: 143.1 °C; (20)Enthalpy of Vaporization: 48.77 kJ/mol; (21)Boiling Point: 270 °C at 760 mmHg; (22)Vapour Pressure: 0.0116 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(nn1)C(C)(C)C
(2)Std. InChI: InChI=1S/C8H11ClN2/c1-8(2,3)6-4-5-7(9)11-10-6/h4-5H,1-3H3
(3)Std. InChIKey: BMEMBHNMSYYDTO-UHFFFAOYSA-N

Product Name

3-CHLORO-6-(1,1-DIMETHYLETHYL)-PYRIDAZINE

Pyridazine,3-chloro-6-(1,1-dimethylethyl)- Specification

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