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| CAS No.: | 66228-31-7 |
|---|---|
| Name: | (R)-3,3-DIMETHYL-2-AMINOBUTANE |
| Molecular Structure: | |
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|
| Formula: | C6H15N |
| Molecular Weight: | 101.192 |
| Synonyms: | 2-Butanamine,3,3-dimethyl-, (R)-;((1R)-1,2,2-Trimethylpropyl)amine;(-)-((R)-3,3-Dimethylbutan-2-yl)amine;(-)-2,2-Dimethyl-3-aminobutane;(-)-2-Amino-3,3-dimethylbutane;(2R)-3,3-Dimethyl-2-butanamine;(R)-(-)-2-Amino-3,3-dimethylbutane;(R)-(-)-3,3-Dimethyl-2-butylamine;(R)-1,2,2-Trimethylpropylamine;(R)-3,3-Dimethyl-2-butanamine; |
| EINECS: | -0 |
| Density: | 0.768 g/cm3 |
| Melting Point: | -4 °C |
| Boiling Point: | 99.3 °C at 760 mmHg |
| Flash Point: | 1.1 °C |
| Solubility: | at 25 deg C (mg/L): 4.769e+004 |
| Hazard Symbols: |
 C F
|
| Risk Codes: | 11-34-22 |
| Safety: | 16-26-36/37/39-45 |
| Transport Information: | UN 2733 |
| PSA: | 26.02000 |
| LogP: | 2.08000 |
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Specification
The (R)-(-)-3,3-Dimethyl-2-butylamine, with the cas registry number 66228-31-7, has the systematic name of (2R)-3,3-dimethylbutan-2-amine. And the molecular formula of the chemical is C6H15N.
The characteristics of this chemical are as followings: (1)ACD/LogP: 1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.66; (4)ACD/LogD (pH 7.4): -1.5; (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: 1.419; (14)Molar Refractivity: 33.3 cm3; (15)Molar Volume: 131.6 cm3; (16)Polarizability: 13.2×10-24cm3; (17)Surface Tension: 24.3 dyne/cm; (18)Density: 0.768 g/cm3; (19)Flash Point: 1.1 °C; (20)Enthalpy of Vaporization: 33.87 kJ/mol; (21)Boiling Point: 99.3 °C at 760 mmHg; (22)Vapour Pressure: 38.4 mmHg at 25°C.
You should be cautious while dealing with this chemical. It is a kind of highly flammable chemical which is harmful if swallowed and may it cause burns. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection; Keep away from sources of ignition - No smoking; In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N[C@H](C)C(C)(C)C
(2)InChI: IInChI=1/C6H15N/c1-5(7)6(2,3)4/h5H,7H2,1-4H3/t5-/m1/s1
(3)InChIKey: DXSUORGKJZADET-RXMQYKEDBE