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CAS No.: | 4361-44-8 |
---|---|
Name: | 3-CYCLOHEXYL-PROPYLAMINE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C9H19N |
Molecular Weight: | 141.257 |
Synonyms: | 3-Cyclohexyl-propylamine; |
Density: | 0.86 g/cm3 |
Boiling Point: | 191.846 °C at 760 mmHg |
Flash Point: | 64.68 °C |
PSA: | 26.02000 |
LogP: | 3.00590 |
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The Cyclohexanepropanamine, with the CAS registry number of 4361-44-8, is also known as 3-Cyclohexyl-propylamine. This chemical's molecular formula is C9H19N and molecular weight is 141.25. What's more, its systematic name is 3-Cyclohexylpropan-1-amine.
Physical properties about the Cyclohexanepropanamine are: (1)ACD/LogP: 3.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 26.02 Å2; (12)Index of Refraction: 1.462; (13)Molar Refractivity: 45.165 cm3; (14)Molar Volume: 164.21 cm3; (15)Surface Tension: 32.869 dyne/cm; (16)Density: 0.86 g/cm3; (17)Flash Point: 64.68 °C; (18)Enthalpy of Vaporization: 42.805 kJ/mol; (19)Boiling Point: 191.846 °C at 760 mmHg; (20)Vapour Pressure: 0.504 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: NCCCC1CCCCC1
(2) InChI: InChI=1/C9H19N/c10-8-4-7-9-5-2-1-3-6-9/h9H,1-8,10H2
(3) InChIKey: KPOYTMZDCUXJBP-UHFFFAOYAH