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Peroxydicarbonic acid,C,C'-ditetradecyl ester (53220-22-7)

Identification
Name:Peroxydicarbonic acid,C,C'-ditetradecyl ester
Synonyms:Peroxydicarbonicacid, ditetradecyl ester (9CI);Dimyristyl peroxydicarbonate;Ditetradecylperoxydicarbonate;Perkadox 26;Perkadox 26W40;Perkadox 26fl;Peroyl MSP;
CAS:53220-22-7
EINECS: 258-436-4
Molecular Formula: C30H58O6
Molecular Weight: 514.78
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
Molecular Structure: (C30H58O6) Peroxydicarbonicacid, ditetradecyl ester (9CI);Dimyristyl peroxydicarbonate;Ditetradecylperoxydicarb...
Properties
Transport:UN 2595/2892
Density:0.947 g/cm3
Stability:No data.
Refractive index:1.457
Solubility:3.9E-8 G/L
Appearance:Must be stored with stringent temperature control measures.
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

Packinggroup: II
Storage Temperature: Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage.
Safety Data
 

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