Allyl cyclohexylpropionate

• Catalog Number: ACM2705875
• Product Name: Allyl cyclohexylpropionate
• CAS: 2705-87-5
• Category: Heterocyclic Organic Compound
• Description: Liquid;Colourless liquid with a pineapple odour
• IUPAC Name: prop-2-enyl 3-cyclohexylpropanoate
• Molecular Weight: 196.29g/mol
• Molecular Formula: C12H20O2
• Canonical SMILES: C=CCOC(=O)CCC1CCCCC1
• InChI: InChI=1S/C12H20O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2,11H,1,3-10H2
• InChI Key: TWXUTZNBHUWMKJ-UHFFFAOYSA-N
• Density: d2525 0.95;0.945-0.950
• Solubility: Soluble in ether, higher oils and fatty oils. Insoluble in glycerine and water;1ml in 4ml 80% ethanol (in ethanol)
• Complexity: 181
• Covalently-Bonded Unit Count: 1
• EC Number: 220-292-5
• Exact Mass: 196.14633g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 14
• Monoisotopic Mass: 196.14633g/mol
• Refractive Index: n20D 1.4600;1.457-1.462
• Rotatable Bond Count: 6
• UNII: H4W9H3L241
• XLogP3: 3.8