Santalyl acetate

Base Information

• Chemical Name: Santalyl acetate
• CAS No.: 1323-00-8
• Molecular Formula: C17H26 O2
• Molecular Weight: 262.39
• European Community (EC) Number: 215-349-6
• Metabolomics Workbench ID: 45572
• Mol file: 1323-00-8.mol

Synonyms:Santalyl acetate;Santalol acetate;Santalylacetat;.beta.-Santanol acetate;(Z)-.beta.-Santalol, acetate;2-methyl-5-{2-methyl-3-methylidenebicyclo[2.2.1]heptan-2-yl}pent-2-en-1-yl acetate;CHEBI:168512;RCFGRZLLBGMERD-WUXMJOGZSA-N;(2E)-2-Methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-2-pentenyl acetate #;(E)-2-methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]heptan-2-yl)pent-2-enyl acetate;[(E)-2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-2-enyl] acetate

Chemical Property of Santalyl acetate

Chemical Property:

• Vapor Pressure: 0.000114mmHg at 25°C
• Boiling Point: 336.2°Cat760mmHg
• Flash Point: 108.6°C
• PSA: 26.30000
• Density: 0.99g/cm³
• LogP: 4.26840
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 262.193280068
• Heavy Atom Count: 19
• Complexity: 408

Purity/Quality:

98%min ^*data from raw suppliers

SANTALOL ACETATE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC1(C2CCC(C2)C1=C)C)COC(=O)C
• Isomeric SMILES: C/C(=C\CCC1(C2CCC(C2)C1=C)C)/COC(=O)C