alpha-Amylcinnamyl isovalerate

Base Information

• Chemical Name: alpha-Amylcinnamyl isovalerate
• CAS No.: 7493-80-3
• Molecular Formula: C19H28 O2
• Molecular Weight: 288.42
• European Community (EC) Number: 616-173-6
• UNII: ZR2O0NCP37
• DSSTox Substance ID: DTXSID10920523
• Wikidata: Q27295852
• Metabolomics Workbench ID: 47264
• Mol file: 7493-80-3.mol

Synonyms:ALPHA-AMYLCINNAMYL ISOVALERATE;alpha-Pentylcinnamyl isovalerate;2-Benzylidene-1-heptyl isovalerate;ZR2O0NCP37;2-Benzylideneheptyl isovalerate;FEMA No. 2067;Butanoic acid, 3-methyl-, 2-(phenylmethylene)heptyl ester;2-(Phenylmethylene)heptyl 3-methylbutanoate;alpha-Amylcinnamyl isovalerianate;Isovaleric acid, beta-pentylcinnamyl ester;alpha-Amyl-beta-phenylacryl 3-methylbutanoate;7493-80-3;a-Amylcinnamyl isovalerate;UNII-ZR2O0NCP37;alpha-amyl cinnamyl isovalerate;SCHEMBL2533963;FEMA 2067;DTXSID10920523;.ALPHA.-AMYLCINNAMYL-ISOVALERATE;.ALPHA.-PENTYLCINNAMYL ISOVALERATE;.ALPHA.-AMYLCINNAMYL ISOVALERATE-[FHFI];Q27295852;(2Z)-2-(PHENYLMETHYLIDENE)HEPTYL 3-METHYLBUTANOATE

Chemical Property of alpha-Amylcinnamyl isovalerate

Chemical Property:

• Vapor Pressure: 2.16E-06mmHg at 25°C
• Boiling Point: 393.3°C at 760 mmHg
• Flash Point: 123°C
• PSA: 26.30000
• Density: 0.964g/cm³
• LogP: 5.23800
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 288.208930132
• Heavy Atom Count: 21
• Complexity: 312

Purity/Quality:

97% ^*data from raw suppliers

ALPHA-AMYLCINNAMYL ISOVALERATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(=CC1=CC=CC=C1)COC(=O)CC(C)C
• Isomeric SMILES: CCCCC/C(=C/C1=CC=CC=C1)/COC(=O)CC(C)C