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| CAS No.: | 594-39-8 |
|---|---|
| Name: | TERT-AMYLAMINE |
| Article Data: | 33 |
| Molecular Structure: | |
|
|
|
| Formula: | C5H13N |
| Molecular Weight: | 87.1649 |
| Synonyms: | 1,1-Dimethylpropylamine;2-Amino-2-methylbutane;2-Methyl-2-butanamine;tert-Amylamine;tert-Pentylamine(6CI,7CI,8CI); |
| EINECS: | 209-839-9 |
| Density: | 0.759 g/cm3 |
| Melting Point: | -105°C |
| Boiling Point: | 77 °C at 760 mmHg |
| Flash Point: | 30 °F |
| Solubility: | Soluble in water |
| Appearance: | clear colorless liquid |
| Hazard Symbols: |
 F, C, T
|
| Risk Codes: | 11-34-25 |
| Safety: | 16-26-27-36/37/39-45 |
| PSA: | 26.02000 |
| LogP: | 1.83400 |
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- Total:26 Page 1 of 1 1
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Specification
The 2-Butanamine, 2-methyl-, with the CAS registry number 594-39-8, is also known as 2-Methyl-butan-2-amine. Its EINECS registry number is 209-839-9. This chemical's molecular formula is C5H13N and molecular weight is 87.16. What's more, both its IUPAC name and systematic name are the same which is called 2-Methylbutan-2-amine. It is clear colorless liquid.
Physical properties about 2-Butanamine, 2-methyl- are: (1) ACD/LogP: 1.10; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -2; (4) ACD/LogD (pH 7.4): -1.81; (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): 1; (9) #H bond acceptors: 1; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 3.24 Å2; (13) Index of Refraction: 1.414; (14) Molar Refractivity: 28.71 cm3; (15) Molar Volume: 114.7 cm3; (16) Surface Tension: 24.4 dyne/cm; (17) Density: 0.759 g/cm3; (18) Boiling Point: 77 °C at 760 mmHg; (19) Vapour Pressure: 98.5 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical may cause damage to health at low levels and it may destroy living tissue on contacting. It is highly flammable and toxic if swallowed. What's more, it could cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water. In addition, you should keep away from sources of ignition and should take off immediately all contaminated clothing. And in case of other accidents or if you feel unwell seek medical advice immediately.
You can still convert the following datas into molecular structure:
(1) SMILES: NC(C)(C)CC
(2) InChI: InChI=1/C5H13N/c1-4-5(2,3)6/h4,6H2,1-3H3
(3) InChIKey: GELMWIVBBPAMIO-UHFFFAOYAS