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12-Methacryloyldodeylphosphate

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Name

12-Methacryloyldodeylphosphate

EINECS
CAS No. 85590-00-7 Density 1.136 g/cm3
Solubility Melting Point
Formula C14H27O6P Boiling Point 450.2 °C at 760 mmHg
Molecular Weight 322.33 Flash Point 226.1 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 85590-00-7 (12-Methacryloyldodeylphosphate) Hazard Symbols
Synonyms

Methacryloyloxydecyl dihydrogen phosphate;MADDP;Cesead opaque primer;10-(Phosphonooxy)decyl 2-methylprop-2-enoate;New Panavia TPN-S;2-Propenoic acid,2-methyl-,esters,10- (phosphonooxy)decyl ester;

 

12-Methacryloyldodeylphosphate Specification

The 12-Methacryloyldodeylphosphate, with the CAS registry number 85590-00-7, is also known as Methacryloyloxydecyl dihydrogen phosphate. This chemical's molecular formula is C14H27O6P and molecular weight is 322.33. What's more, its systematic name is 10-(phosphonooxy)decyl 2-methylprop-2-enoate.

Physical properties of 12-Methacryloyldodeylphosphate are: (1)ACD/LogP: 3.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.04; (4)ACD/LogD (pH 7.4): -0.96; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 80.87 Å2; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 79.94 cm3; (15)Molar Volume: 283.5 cm3; (16)Polarizability: 31.69×10-24cm3; (17)Surface Tension: 42.5 dyne/cm; (18)Density: 1.136 g/cm3; (19)Flash Point: 226.1 °C; (20)Enthalpy of Vaporization: 77.72 kJ/mol; (21)Boiling Point: 450.2 °C at 760 mmHg; (22)Vapour Pressure: 2.33E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P(OCCCCCCCCCCOC(=O)\C(=C)C)(O)O
(2)InChI: InChI=1S/C14H27O6P/c1-13(2)14(15)19-11-9-7-5-3-4-6-8-10-12-20-21(16,17)18/h1,3-12H2,2H3,(H2,16,17,18)
(3)InChIKey: CFKBCVIYTWDYRP-UHFFFAOYSA-N

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