2-Propenoic acid,2-methyl-, isooctyl ester supplier

Name
ISO-OCTYL METHACRYLATE
EINECS 249-144-8
CAS No. 28675-80-1
Density 0.879 g/cm³
Solubility
Melting Point
Formula C₁₂H₂₂O₂
Boiling Point 247 °C at 760 mmHg
Molecular Weight 198.3
Flash Point 91.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methacrylicacid, isooctyl ester (7CI);Isooctyl methacrylate;6-Methylheptyl 2-methylprop-2-enoate;2-Methyl-2-propenoicaciisooctylester;
PSA 26.30000
LogP 3.32210

2-Propenoic acid,2-methyl-, isooctyl ester Specification

The 2-Propenoic acid,2-methyl-, isooctyl ester, with the CAS registry number 28675-80-1, is also known as Iso-octyl methacrylate. Its EINECS number is 249-144-8. It belongs to the product category of Monomer. This chemical's molecular formula is C₁₂H₂₂O₂ and molecular weight is 198.3. What's more, its systematic name is 6-Methylheptyl 2-methylprop-2-enoate.

Physical properties of 2-Propenoic acid,2-methyl-, isooctyl ester are: (1)ACD/LogP: 4.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.88; (4)ACD/LogD (pH 7.4): 4.88; (5)ACD/BCF (pH 5.5): 3017.22; (6)ACD/BCF (pH 7.4): 3017.22; (7)ACD/KOC (pH 5.5): 10772.02; (8)ACD/KOC (pH 7.4): 10772.02; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.436; (14)Molar Refractivity: 58.94 cm³; (15)Molar Volume: 225.3 cm³; (16)Polarizability: 23.36×10^-24cm³; (17)Surface Tension: 27.6 dyne/cm; (18)Density: 0.879 g/cm³; (19)Flash Point: 91.4 °C; (20)Enthalpy of Vaporization: 48.41 kJ/mol; (21)Boiling Point: 247 °C at 760 mmHg; (22)Vapour Pressure: 0.0263 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)CCCCCOC(=O)C(=C)C
(2)InChI: InChI=1S/C12H22O2/c1-10(2)8-6-5-7-9-14-12(13)11(3)4/h10H,3,5-9H2,1-2,4H3
(3)InChIKey: NQSLZEHVGKWKAY-UHFFFAOYSA-N

Product Name

ISO-OCTYL METHACRYLATE

2-Propenoic acid,2-methyl-, isooctyl ester Specification

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