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Dimyristyl peroxydicarbonate

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Name

Dimyristyl peroxydicarbonate

EINECS 258-436-4
CAS No. 53220-22-7 Density 0.947 g/cm3
PSA 71.06000 LogP 10.61000
Solubility 5μg/L at 20℃ Melting Point N/A
Formula C30H58O6 Boiling Point 546.7 °C at 760 mmHg
Molecular Weight 514.78 Flash Point 222.6 °C
Transport Information UN 2595/2892 Appearance Must be stored with stringent temperature control measures.
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 53220-22-7 (Dimyristyl peroxydicarbonate) Hazard Symbols N/A
Synonyms

Peroxydicarbonicacid, ditetradecyl ester (9CI);Dimyristyl peroxydicarbonate;Ditetradecylperoxydicarbonate;Perkadox 26;Perkadox 26W40;Perkadox 26fl;Peroyl MSP;

 

Dimyristyl peroxydicarbonate Specification

The Dimyristyl peroxydicarbonate, with CAS registry number 53220-22-7, has the systematic name of 1,1'-[dioxybis(carbonyloxy)]ditetradecane. And its IUPAC name is tetradecoxycarbonyloxy tetradecyl carbonate. And the chemical formula of this chemical is C30H58O6. What's more, its EINECS is 258-436-4.

Physical properties of Dimyristyl peroxydicarbonate: (1)ACD/LogP: 14.69; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 14.69; (4)ACD/LogD (pH 7.4): 14.69; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 31; (12)Polar Surface Area: 71.06 Å2; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 148.07 cm3; (15)Molar Volume: 543.4 cm3; (16)Polarizability: 58.7×10-24cm3; (17)Surface Tension: 34.2 dyne/cm; (18)Enthalpy of Vaporization: 82.58 kJ/mol; (19)Vapour Pressure: 5.25E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OOC(=O)OCCCCCCCCCCCCCC)OCCCCCCCCCCCCCC
(2)InChI: InChI=1/C30H58O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-33-29(31)35-36-30(32)34-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
(3)InChIKey: CSKKAINPUYTTRW-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C30H58O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-33-29(31)35-36-30(32)34-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
(5)Std. InChIKey: CSKKAINPUYTTRW-UHFFFAOYSA-N

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