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| CAS No.: | 1743-56-2 |
|---|---|
| Name: | isobutylidene(ethyl)amine |
| Article Data: | 6 |
| Molecular Structure: | |
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| Formula: | C6H13N |
| Molecular Weight: | 99.1759 |
| Synonyms: | Ethylamine,N-isobutylidene- (6CI,7CI,8CI);N-Ethyl-2-methylpropanimine; |
| EINECS: | 217-113-8 |
| Density: | 0.75 g/cm3 |
| Boiling Point: | 128.7 °C at 760 mmHg |
| Flash Point: | 22.6 °C |
| PSA: | 12.36000 |
| LogP: | 1.73310 |
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- Total:3 Page 1 of 1 1
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Specification
The Ethanamine,N-(2-methylpropylidene)-, with the CAS registry number 1743-56-2, is also known as Ethylamine,N-isobutylidene- (6CI,7CI,8CI). Its EINECS registry number is 217-113-8. This chemical's molecular formula is C6H13N and molecular weight is 99.1741. What's more, its IUPAC name is N-Ethyl-2-methylpropan-1-imine.
Physical properties about Ethanamine,N-(2-methylpropylidene)- are: (1)ACD/LogP: 1.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.14; (4)ACD/LogD (pH 7.4): 1.42; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 6.42; (7)ACD/KOC (pH 5.5): 6.21; (8)ACD/KOC (pH 7.4): 118.26; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.36 Å2; (13)Index of Refraction: 1.414; (14)Molar Refractivity: 32.69 cm3; (15)Molar Volume: 130.7 cm3; (16)Polarizability: 12.95×10-24 cm3; (17)Surface Tension: 22 dyne/cm; (18)Density: 0.75 g/cm3; (19)Flash Point: 22.6 °C; (20)Enthalpy of Vaporization: 35.12 kJ/mol; (21)Boiling Point: 128.7 °C at 760 mmHg; (22)Vapour Pressure: 12.8 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: CC(C)C=NCC
(2) InChI: InChI=1/C6H13N/c1-4-7-5-6(2)3/h5-6H,4H2,1-3H3
(3) InChIKey: BBFMJBUMAHUJAH-UHFFFAOYAR