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CAS No.: | 108766-06-9 |
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Name: | 2,5-Dichloropentylamine |
Molecular Structure: | |
Formula: | C5H11Cl2N |
Molecular Weight: | 156.055 |
Synonyms: | 2,5-dichloropentan-1-amine;1-pentanamine, 2,5-dichloro-;2,5-Dichloroamylamine Hydrochloride; |
Density: | 1.131 g/cm3 |
Boiling Point: | 213.8 °C at 760 mmHg |
Flash Point: | 83.1 °C |
PSA: | 26.02000 |
LogP: | 3.07380 |
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The 2,5-Dichloropentylamine, with the CAS registry number 108766-06-9, has the systematic name of 2,5-dichloropentan-1-amine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C5H11Cl2N.
The characteristics of 2,5-Dichloropentylamine are as followings: (1)ACD/LogP: 1.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.02; (4)ACD/LogD (pH 7.4): 0.62; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1.41; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 34.39; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.469; (14)Molar Refractivity: 38.4 cm3; (15)Molar Volume: 137.8 cm3; (16)Polarizability: 15.22×10-24cm3; (17)Surface Tension: 34.5 dyne/cm; (18)Density: 1.131 g/cm3; (19)Flash Point: 83.1 °C; (20)Enthalpy of Vaporization: 45.01 kJ/mol; (21)Boiling Point: 213.8 °C at 760 mmHg; (22)Vapour Pressure: 0.161 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: ClCCCC(Cl)CN
(2)InChI: InChI=1/C5H11Cl2N/c6-3-1-2-5(7)4-8/h5H,1-4,8H2
(3)InChIKey: KFAUCDBUVPJWSB-UHFFFAOYAY