ethenyl dodecanoate

• ChemBase ID: 111604
• Molecular Formular: C14H26O2
• Molecular Mass: 226.35504
• Monoisotopic Mass: 226.19328007
• SMILES: CCCCCCCCCCCC(=O)OC=C
• Canonical SMILES: CCCCCCCCCCCC(=O)OC=C
• InChI: InChI=1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h4H,2-3,5-13H2,1H3
• InChIKey: GLVVKKSPKXTQRB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethenyl dodecanoate
• IUPAC Traditional name: ethenyl dodecanoate
• Synonyms: VINYL LAURATE; VL; Vinyl laurate; 月桂酸乙烯酯

Database IDs

• CAS Number: 2146-71-6
• EC Number: 218-414-7
• MDL Number: MFCD00048421
• Beilstein Number: 1778369
• PubChem SID: 162097195; 24874833; 24846844
• PubChem CID: 75069

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 5.1288767
• LogD (pH = 7.4): 5.1288767
• Log P: 5.1288767
• Molar Refractivity: 67.1409 cm^3
• Polarizability: 27.045694 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Boiling Point: 254 °C/1013 hPa(lit.)
• Flash Point: 125 °C; 136 °C; 257 °F; 276.8 °F
• Density: 0.871 g/mL at 20 °C(lit.); 1.4 g/ml
• Refractive Index: n20/D 1.441

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves

Product Information

• Purity: ≥98.0% (GC); ≥99.0% (GC)
• Grade: produced by Wacker
• Linear Formula: CH3(CH2)10COOCH=CH2

DETAILS

MP Biomedicals - 05219999

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 10896

Other Notes
根据要求提供批量采购价
包装
1 kg in glass bottle

Sigma Aldrich - 61725

Packaging
1 L in glass bottle
250 mL in glass bottle