2-(Phenylmethylene)heptyl acetate

Base Information

• Chemical Name: 2-(Phenylmethylene)heptyl acetate
• CAS No.: 7493-78-9
• Molecular Formula: C16H22 O2
• Molecular Weight: 246.38
• Hs Code.: 2918195000
• European Community (EC) Number: 231-339-4
• UNII: F2PZ1U43HO
• Nikkaji Number: J60.245K
• Wikidata: Q27277551
• RXCUI: 2395800
• Mol file: 7493-78-9.mol

Synonyms:UNII-VMT186NL85;2-(Phenylmethylene)heptyl acetate;alpha-Amylcinnamyl acetate;7493-78-9;Amyl cinnamic acetate;1-Heptanol,2-(phenylmethylene)-, 1-acetate;alpha-Pentylcinnamyl acetate;alpha-Pentyl cinnamyl acetate;FEMA No. 2064;1-Heptanol, 2-(phenylmethylene)-, acetate;2-Benzylidene-1-heptyl acetate;2-Benzylidene-1-heptanol acetate;alpha-Amyl-beta-phenylacryl acetate;EINECS 231-339-4;alpha-n-Amyl-beta-phenylacryl acetate;1-Heptanol, 2-benzylidene-, acetate;2-(Phenylmethylene)-1-heptyl acetate;2-(Phenylmethylene)-1-heptanol acetate;1-Heptanol, 2-(phenylmethylene)-, 1-acetate;2 - (phenylmethylene)heptyl acetate;CINNAMYL ALCOHOL, alpha-PENTYL-, ACETATE;F2PZ1U43HO;(E)-alpha-amylcinnamyl acetate;SCHEMBL1171596;VMT186NL85;2-Pentyl-3-phenyl-2-propen-1-ol acetate;.ALPHA.-AMYLCINNAMYL ACETATE, (E)-;Q27277551;1-HEPTANOL, 2-(PHENYLMETHYLENE)-, 1-ACETATE, (E)-

Chemical Property of 2-(Phenylmethylene)heptyl acetate

Chemical Property:

• Vapor Pressure: 3.47E-05mmHg at 25°C
• Refractive Index: 1.4700 (estimate)
• Boiling Point: 353.9°C at 760 mmHg
• Flash Point: 128.3°C
• PSA: 26.30000
• Density: 0.986g/cm³
• LogP: 4.21340
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 246.161979940
• Heavy Atom Count: 18
• Complexity: 262

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-BENZYLIDENEHEPTYL ACETATE ^*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)C
• Isomeric SMILES: CCCCC/C(=C\C1=CC=CC=C1)/COC(=O)C
• Uses: α-Amylcinnamyl Acetate can be used for fragrant substances for hair cosmetics.