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3-(Diethylamino)-2,2-dimethylpropan-1-ol

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Name

3-(Diethylamino)-2,2-dimethylpropan-1-ol

EINECS N/A
CAS No. 39067-45-3 Density 0.875 g/cm3
PSA 23.47000 LogP 1.34670
Solubility N/A Melting Point N/A
Formula C9H21NO Boiling Point 226.6 °C at 760 mmHg
Molecular Weight 159.272 Flash Point 73.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 39067-45-3 (3-(Diethylamino)-2,2-dimethylpropan-1-ol) Hazard Symbols N/A
Synonyms

3-(Diethylamino)-2,2-dimethylpropanol;NSC 165636;

 

3-(Diethylamino)-2,2-dimethylpropan-1-ol Specification

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

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