Basic Information | Post buying leads | Suppliers |
Name |
3-Pyridazinamine,6-chloro-N-(3-methoxypropyl)- |
EINECS | N/A |
CAS No. | 898656-60-5 | Density | 1.236 g/cm3 |
PSA | 47.04000 | LogP | 1.65140 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H12ClN3O | Boiling Point | 397.509 °C at 760 mmHg |
Molecular Weight | 201.6534 | Flash Point | 194.207 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
F3266-0103 |
The 3-Pyridazinamine,6-chloro-N-(3-methoxypropyl)-, with CAS registry number 898656-60-5, belongs to the following product categories: (1)Amines; (2)Blocks. It has the systematic name of 6-chloro-N-(3-methoxypropyl)pyridazin-3-amine. And the chemical formula of this chemical is C8H12ClN3O.
Physical properties of 3-Pyridazinamine,6-chloro-N-(3-methoxypropyl)-: (1)ACD/LogP: 0.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 64; (8)ACD/KOC (pH 7.4): 65; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 47.04 Å2; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 52.584 cm3; (15)Molar Volume: 163.171 cm3; (16)Polarizability: 20.846×10-24cm3; (17)Surface Tension: 47.938 dyne/cm; (18)Enthalpy of Vaporization: 64.796 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nnc(NCCCOC)cc1
(2)InChI: InChI=1/C8H12ClN3O/c1-13-6-2-5-10-8-4-3-7(9)11-12-8/h3-4H,2,5-6H2,1H3,(H,10,12)
(3)InChIKey: CPBNDYWWQHHHFQ-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C8H12ClN3O/c1-13-6-2-5-10-8-4-3-7(9)11-12-8/h3-4H,2,5-6H2,1H3,(H,10,12)
(5)Std. InChIKey: CPBNDYWWQHHHFQ-UHFFFAOYSA-N