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CAS No.: | 39067-45-3 |
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Name: | 3-(Diethylamino)-2,2-dimethylpropan-1-ol |
Molecular Structure: | |
Formula: | C9H21NO |
Molecular Weight: | 159.272 |
Synonyms: | 3-(Diethylamino)-2,2-dimethylpropanol;NSC 165636; |
Density: | 0.875 g/cm3 |
Boiling Point: | 226.6 °C at 760 mmHg |
Flash Point: | 73.9 °C |
PSA: | 23.47000 |
LogP: | 1.34670 |
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The 1-Propanol,3-(diethylamino)-2,2-dimethyl- is an organic compound with the formula C9H21NO. The IUPAC name of this chemical is 3-(diethylamino)-2,2-dimethylpropan-1-ol. With the CAS registry number 39067-45-3, it is also named as 3-Diethylamino-2,2-Dimethyl-1-Propanol.
Physical properties about 1-Propanol,3-(diethylamino)-2,2-dimethyl- are: (1)ACD/LogP: 1.27; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 6; (5)Polar Surface Area: 12.47 Å2; (6)Index of Refraction: 1.45; (7)Molar Refractivity: 48.96 cm3; (8)Molar Volume: 181.9 cm3; (9)Polarizability: 19.41×10-24cm3; (10)Surface Tension: 30.5 dyne/cm; (11)Density: 0.875 g/cm3; (12)Flash Point: 73.9 °C; (13)Enthalpy of Vaporization: 53.85 kJ/mol; (14)Boiling Point: 226.6 °C at 760 mmHg; (15)Vapour Pressure: 0.016 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OCC(C)(C)CN(CC)CC
(2)InChI: InChI=1/C9H21NO/c1-5-10(6-2)7-9(3,4)8-11/h11H,5-8H2,1-4H3
(3)InChIKey: YOWSYKCRNIREGL-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C9H21NO/c1-5-10(6-2)7-9(3,4)8-11/h11H,5-8H2,1-4H3
(5)Std. InChIKey: YOWSYKCRNIREGL-UHFFFAOYSA-N