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CAS No.: | 41331-10-6 |
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Name: | Glycine, N-hexyl- |
Molecular Structure: | |
Formula: | C8H17NO2 |
Molecular Weight: | 159.23 |
Density: | 0.971 g/cm3 |
Boiling Point: | 258.346 °C at 760 mmHg |
Flash Point: | 110.044 °C |
The CAS registry number of Glycine, N-hexyl- is 41331-10-6. This chemical's molecular formula is C8H17NO2 and molecular weight is 159.23. What's more, its systematic name is called N-Hexylglycine.
Physical properties about Glycine, N-hexyl- are: (1)ACD/LogP: 3.147; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.65; (4)ACD/LogD (pH 7.4): 0.65; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 3.88; (8)ACD/KOC (pH 7.4): 3.88; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 49.33 Å2; (13)Index of Refraction: 1.452; (14)Molar Refractivity: 44.271 cm3; (15)Molar Volume: 164.031 cm3; (16)Polarizability: 17.551×10-24cm3; (17)Surface Tension: 35.428 dyne/cm; (18)Density: 0.971 g/cm3; (19)Flash Point: 110.044 °C; (20)Enthalpy of Vaporization: 54.601 kJ/mol; (21)Boiling Point: 258.346 °C at 760 mmHg; (22)Vapour Pressure: 0.004 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)CNCCCCCC
(2) InChI: InChI=1S/C8H17NO2/c1-2-3-4-5-6-9-7-8(10)11/h9H,2-7H2,1H3,(H,10,11)
(3) InChIKey: DAQPDSNNUNDKNX-UHFFFAOYSA-N