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Name	Bis(2-methylpropyl) oxalate	EINECS	N/A
CAS No.	2050-61-5	Density	1.004 g/cm³
PSA	52.60000	LogP	1.38480
Solubility	N/A	Melting Point	N/A
Formula	C₁₀H₁₈O₄	Boiling Point	229 °C at 760 mmHg
Molecular Weight	202.251	Flash Point	96.1 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Ethanedioicacid, bis(2-methylpropyl) ester (9CI);Oxalic acid, diisobutyl ester (6CI);Diisobutyl oxalate;NSC 67394;

Bis(2-methylpropyl) oxalate Specification

The Bis(2-methylpropyl) oxalate, with the cas registry number 2050-61-5, has the systematic name of bis(2-methylpropyl) ethanedioate. And the molecular formula of the chemical is C₁₀H₁₈O₄.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.48; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 52.6Å²; (7)Index of Refraction: 1.428; (8)Molar Refractivity: 51.84 cm³; (9)Molar Volume: 201.3 cm³; (10)Polarizability: 20.55×10^-24cm³; (11)Surface Tension: 30.7 dyne/cm; (12)Density: 1.004 g/cm³; (13)Flash Point: 96.1 °C; (14)Enthalpy of Vaporization: 46.56 kJ/mol; (15)Boiling Point: 229 °C at 760 mmHg; (16)Vapour Pressure: 0.0712 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OCC(C)C)C(=O)OCC(C)C
(2)InChI: InChI=1/C10H18O4/c1-7(2)5-13-9(11)10(12)14-6-8(3)4/h7-8H,5-6H2,1-4H3
(3)InChIKey: GJRRTUSXQPXVES-UHFFFAOYAT

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Bis(2-methylpropyl) oxalate Specification