CAS No.29240-17-3,tert-Amyl perpivalate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	29240-17-3
Name:	tert-Amyl perpivalate
Article Data:	5

Formula:	C₁₀H₂₀O₃
Molecular Weight:	188.267
Synonyms:	Peroxypivalicacid, tert-pentyl ester (6CI,8CI);tert-Pentyl alcohol, peroxypivalate (8CI);Esperox 551M;Luperox 544M75;Luperox 554;Lupersol 554;Lupersol 554M75;Lupersol TA 54;Trigonox 125;Trigonox 125C75;tert-Amyl peroxypivalate;tert-Amyl perpivalate;tert-Pentyl peroxypivalate;
EINECS:	249-530-6
Density:	0.924 g/cm³
Boiling Point:	204 °C at 760 mmHg
Flash Point:	59.2 °C
Solubility:	504mg/L at 20℃
PSA:	35.53000
LogP:	2.69590

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Specification

The Propaneperoxoic acid,2,2-dimethyl-, 1,1-dimethylpropyl ester, with the CAS registry number 29240-17-3, is also known as tert-Pentyl peroxypivalate. Its EINECS registry number is 249-530-6. This chemical's molecular formula is C₁₀H₂₀O₃ and molecular weight is 188.264. Its IUPAC name is called 2-methylbutan-2-yl 2,2-dimethylpropaneperoxoate.

Physical properties of Propaneperoxoic acid,2,2-dimethyl-, 1,1-dimethylpropyl ester: (1)ACD/LogP: 3.34; (2)ACD/LogD (pH 5.5): 3.34; (3)ACD/LogD (pH 7.4): 3.34; (4)ACD/BCF (pH 5.5): 203.67; (5)ACD/BCF (pH 7.4): 203.67; (6)ACD/KOC (pH 5.5): 1564.37; (7)ACD/KOC (pH 7.4): 1564.37; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.422; (11)Molar Refractivity: 51.82 cm³; (12)Molar Volume: 203.5 cm³; (13)Surface Tension: 27.1 dyne/cm; (14)Density: 0.924 g/cm³; (15)Flash Point: 59.2 °C; (16)Enthalpy of Vaporization: 44.02 kJ/mol; (17)Boiling Point: 204 °C at 760 mmHg; (18)Vapour Pressure: 0.269 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC(C)(C)OOC(=O)C(C)(C)C
(2)InChI: InChI=1S/C10H20O3/c1-7-10(5,6)13-12-8(11)9(2,3)4/h7H2,1-6H3
(3)InChIKey: AQKYLAIZOGOPAW-UHFFFAOYSA-N