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67634-23-5

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Basic Information
CAS No.: 67634-23-5
Name: 4-METHYL-2-(1-PHENYLETHYL)-1,3-DIOXOLANE
Molecular Structure:
Molecular Structure of 67634-23-5 (4-METHYL-2-(1-PHENYLETHYL)-1,3-DIOXOLANE)
Formula: C12H16O2
Molecular Weight: 192.2542
Synonyms: 2-(α-Methylbenzyl)-4-methyl-1,3-dioxolane;
EINECS: 266-828-1
Density: 1.031 g/cm3
Boiling Point: 259.8 °C at 760 mmHg
Flash Point: 114.4 °C
Appearance: Colorless to pale yellow liquid.
PSA: 18.46000
LogP: 2.55150
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Specification

The 1,3-Dioxolane,4-methyl-2-(1-phenylethyl)-, with the CAS registry number 67634-23-5, is also known as 2-(α-Methylbenzyl)-4-methyl-1,3-dioxolane. Its EINECS registry number is 266-828-1. This chemical's molecular formula is C12H16O2 and molecular weight is 192.2542. What's more, both its IUPAC name and systematic name are the same which is 4-Methyl-2-(1-phenylethyl)-1,3-dioxolane.

Physical properties about 1,3-Dioxolane,4-methyl-2-(1-phenylethyl)- are: (1)ACD/LogP: 2.30; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.508; (8)Molar Refractivity: 55.55 cm3; (9)Molar Volume: 186.3 cm3; (10)Polarizability: 22.02×10-24 cm3; (11)Surface Tension: 36.5 dyne/cm; (12)Density: 1.031 g/cm3; (13)Flash Point: 114.4 °C; (14)Enthalpy of Vaporization: 47.74 kJ/mol; (15)Boiling Point: 259.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0206 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O1C(C)COC1C(c2ccccc2)C
(2) InChI: InChI=1/C12H16O2/c1-9-8-13-12(14-9)10(2)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3
(3) InChIKey: KHLVXMUGPANNQD-UHFFFAOYAZ