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74185-61-8

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Basic Information
CAS No.: 74185-61-8
Name: 2,2-Difluoro-3-methylpentane
Molecular Structure:
Molecular Structure of 74185-61-8 (2,2-Difluoro-3-methylpentane)
Formula: C6H12F2
Molecular Weight: 122.158
Synonyms: 2,2-Difluoro-3-methylpentane;
Density: 0.879 g/cm3
Boiling Point: 87.6 °C at 760 mmHg
Flash Point: 0.6 °C
PSA: 0.00000
LogP: 2.68770
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Specification

The CAS registry number of Butane,2,2-difluoro-3,3-dimethyl- is 74185-61-8. This chemical's molecular formula is C6H12F2 and molecular weight is 122.1563. What's more, both its IUPAC name and systematic name are the same which is called 2,2-Difluoro-3-methylpentane.

Physical properties about Butane,2,2-difluoro-3,3-dimethyl- are: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.41; (4)ACD/LogD (pH 7.4): 2.41; (5)ACD/BCF (pH 5.5): 40; (6)ACD/BCF (pH 7.4): 40; (7)ACD/KOC (pH 5.5): 487.98; (8)ACD/KOC (pH 7.4): 487.98; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.352; (14)Molar Refractivity: 30.09 cm3; (15)Molar Volume: 138.8 cm3; (16)Polarizability: 11.93×10-24 cm3; (17)Surface Tension: 17 dyne/cm; (18)Density: 0.879 g/cm3; (19)Flash Point: 0.6 °C; (20)Enthalpy of Vaporization: 31.42 kJ/mol; (21)Boiling Point: 87.6 °C at 760 mmHg; (22)Vapour Pressure: 71.3 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(CC)C(C)(F)F
(2) InChI: InChI=1/C6H12F2/c1-4-5(2)6(3,7)8/h5H,4H2,1-3H3
(3) InChIKey: NSBQAUADNQVRNT-UHFFFAOYAD