3,3-Dimethylpentane

The CAS register number of Pentane, 3,3-dimethyl- is 562-49-2. It also can be called as 2-Ethyl-2-methylbutane and the IUPAC name about this chemical is 3,3-dimethylpentane. The molecular formula about this chemical is C₇H₁₆ and the molecular weight is 100.2. It belongs to the following product categories which include Acyclic; Alkanes; Organic Building Blocks and so on.

Physical properties about Pentane, 3,3-dimethyl- are: (1)ACD/LogP: 4.11; (2)ACD/LogD (pH 5.5): 4.11; (3)ACD/LogD (pH 7.4): 4.11; (4)ACD/BCF (pH 5.5): 781.51; (5)ACD/BCF (pH 7.4): 781.51; (6)ACD/KOC (pH 5.5): 4096.03; (7)ACD/KOC (pH 7.4): 4096.03; (8)#Freely Rotating Bonds: 2; (9)Index of Refraction: 1.393; (10)Molar Refractivity: 34.44 cm³; (11)Molar Volume: 144.1 cm³; (12)Polarizability: 13.65x10^-24cm³; (13)Surface Tension: 20.2 dyne/cm; (14)Density: 0.695 g/cm³; (15)Enthalpy of Vaporization: 29.62 kJ/mol; (16)Boiling Point: 85.7 °C at 760 mmHg; (17)Vapour Pressure: 76.8 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is highly flammable. It is irritating to skin and very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. This chemical may catch fire if in contact with air, only needing brief contact with an ignition source, and it has a very low flash point or evolve highly flammable gases in contact with water. It is also harmful and may cause damage to health, such as lung damage if swallowed. Vapours may cause drowsiness and dizziness. If you want to store this chemical, keep container in a well-ventilated place and keep away from sources of ignition. If you want to use it, refer to special instructions / safety data sheets and take precautionary measures against static discharges. When you are using it, do not empty into drains and avoid release to the environment This material and its container must be disposed of as hazardous waste. If swallowed, do not induce vomitting; seek medical advice immediately and show this container or label.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(CC)CC
(2)InChI: InChI=1/C7H16/c1-5-7(3,4)6-2/h5-6H2,1-4H3
(3)InChIKey: AEXMKKGTQYQZCS-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C7H16/c1-5-7(3,4)6-2/h5-6H2,1-4H3
(5)Std. InChIKey: AEXMKKGTQYQZCS-UHFFFAOYSA-N