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| CAS No.: | 20677-73-0 |
|---|---|
| Name: | (2,2-diethoxyethyl)methylamine |
| Molecular Structure: | |
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| Formula: | C7H17NO2 |
| Molecular Weight: | 147.217 |
| Synonyms: | Acetaldehyde,(methylamino)-, diethyl acetal (6CI,7CI,8CI);Ethylamine,2,2-diethoxy-N-methyl-;2,2-Diethoxyethylmethylamine;2-(Methylamino)acetaldehydediethyl acetal;Methylaminoacetaldehyde diethyl acetal;N-Methylaminoacetaldehyde diethyl acetal;NSC 66542; |
| EINECS: | 243-960-8 |
| Density: | 0.886g/cm3 |
| Boiling Point: | 162.8 °C at 760 mmHg |
| Flash Point: | 61.5 °C |
| PSA: | 30.49000 |
| LogP: | 0.99580 |
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Specification
The 2,2-Diethoxy-N-methyl-1-ethanamine, with CAS registry number 20677-73-0, has the systematic name of 2,2-diethoxy-N-methylethanamine. And its IUPAC name is the same one. Besides this, it is also called ethanamine, 2,2-diethoxy-N-methyl-. And the chemical formula of this chemical is C7H17NO2. What's more, its EINECS is 243-960-8.
Physical properties of 2,2-Diethoxy-N-methyl-1-ethanamine: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.49; (4)ACD/LogD (pH 7.4): 0.12; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 8.31; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 21.7 Å2; (13)Index of Refraction: 1.414; (14)Molar Refractivity: 41.52 cm3; (15)Molar Volume: 166 cm3; (16)Polarizability: 16.46×10-24cm3; (17)Surface Tension: 26.1 dyne/cm; (18)Enthalpy of Vaporization: 39.94 kJ/mol; (19)Vapour Pressure: 2.13 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(CC)C(OCC)CNC
(2)InChI: InChI=1/C7H17NO2/c1-4-9-7(6-8-3)10-5-2/h7-8H,4-6H2,1-3H3
(3)InChIKey: GHTDAXTYNRRXEC-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C7H17NO2/c1-4-9-7(6-8-3)10-5-2/h7-8H,4-6H2,1-3H3
(5)Std. InChIKey: GHTDAXTYNRRXEC-UHFFFAOYSA-N