decyl 2-methylprop-2-enoate

• ChemBase ID: 108893
• Molecular Formular: C14H26O2
• Molecular Mass: 226.35504
• Monoisotopic Mass: 226.19328007
• SMILES: CCCCCCCCCCOC(=O)C(=C)C
• Canonical SMILES: CCCCCCCCCCOC(=O)C(=C)C
• InChI: InChI=1S/C14H26O2/c1-4-5-6-7-8-9-10-11-12-16-14(15)13(2)3/h2,4-12H2,1,3H3
• InChIKey: GTBGXKPAKVYEKJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: decyl 2-methylprop-2-enoate
• IUPAC Traditional name: decyl 2-methylprop-2-enoate
• Synonyms: n-DECYL METHACRYLATE PRACTICAL GRADE; Decyl methacrylate; 甲基丙烯酸癸酯

Database IDs

• CAS Number: 3179-47-3
• EC Number: 221-657-1
• MDL Number: MFCD00048399
• Beilstein Number: 1769806
• PubChem SID: 162096120; 24850775
• PubChem CID: 18510

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 5.299036
• LogD (pH = 7.4): 5.299036
• Log P: 5.299036
• Molar Refractivity: 67.8972 cm^3
• Polarizability: 27.045694 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 11
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Density: 0.876 g/mL at 20 °C
• Refractive Index: n20/D 1.442

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 1
• Risk Statements: 36/37/38
• Safety Statements: 26-28
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥98.0%; ≥98.0% (GC)
• Grade: PRACTICAL; Selectophore™
• Contains: ~0.01% hydroquinone monomethyl ether as stabilizer
• Linear Formula: CH2=C(CH3)COO(CH2)9CH3

DETAILS

MP Biomedicals - 05209130

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 17886

General description
Visit our Sensor Applications portal to learn more.
Other Notes
Polymer is used for preparing photocrosslinked, durable optical sensors1
Legal Information
Selectophore is a trademark of Sigma-Aldrich GmbH