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| CAS No.: | 66793-76-8 |
|---|---|
| Name: | N-Ethyl-1-heptanamine |
| Molecular Structure: | |
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| Formula: | C9H21N |
| Molecular Weight: | 143.272 |
| Synonyms: | Ethylheptylamine;N-Ethylheptamine;N-Ethylheptylamine; |
| EINECS: | 200-002-4 |
| Density: | 0.77 g/cm3 |
| Melting Point: | -13°C (estimate) |
| Boiling Point: | 186.7 °C at 760 mmHg |
| Flash Point: | 54.1 °C |
| PSA: | 12.03000 |
| LogP: | 2.95720 |
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Specification
The N-Ethyl-1-heptanamine with the CAS number 66793-76-8 is also called 1-Heptanamine, N-ethyl-. Its molecular formula is C9H21N. The product category is Polyamines. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 3.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.19; (4)ACD/LogD (pH 7.4): 0.33; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.17; (8)ACD/KOC (pH 7.4): 1.61; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.422; (14)Molar Refractivity: 47.33 cm3; (15)Molar Volume: 185.9 cm3; (16)Polarizability: 18.76×10-24cm3; (17)Surface Tension: 25.5 dyne/cm; (18)Enthalpy of Vaporization: 42.3 kJ/mol; (19)Vapour Pressure: 0.653 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N(CC)CCCCCCC
(2)InChI: InChI=1/C9H21N/c1-3-5-6-7-8-9-10-4-2/h10H,3-9H2,1-2H3
(3)InChIKey: IUZZLNVABCISOI-UHFFFAOYAJ