1-Butyl-5-carboxypentyl 5-decenoate

Base Information

• Chemical Name: 1-Butyl-5-carboxypentyl 5-decenoate
• CAS No.: 85392-05-8
• Molecular Formula: C20H36O4
• Molecular Weight: 340.4974
• European Community (EC) Number: 286-863-6
• UNII: 07E2BJ3Q3D
• Nikkaji Number: J310.398F
• Wikidata: Q27236301
• Mol file: 85392-05-8.mol

Synonyms:UNII-LSX05I9UYY;EINECS 286-863-6;1-Butyl-5-carboxypentyl 5-decenoate;6-(5-Decenoyloxy)decenoic acid;85392-05-8;LSX05I9UYY;5-Decenoic acid, 1-butyl-5-carboxypentyl ester;6-[(E)-dec-5-enoyl]oxydecanoic acid;07E2BJ3Q3D;6-(5-Decenoyloxy)decanoic acid;(5E)-6-(5-decenoyloxy)decenoic acid;6-(5(6)-decenoyl oxy) decanoic acid;FEMA NO. 4442, 5E-DECENOYLOXY-;6-(5-DECENOYLOXY)DECENOIC ACID, (5E)-;Q27236301;(+/-)-6-(5-DECENOYLOXY)DECENOIC ACID, (5E)-

Chemical Property of 1-Butyl-5-carboxypentyl 5-decenoate

Chemical Property:

• Vapor Pressure: 7.38E-10mmHg at 25°C
• Refractive Index: 1.471
• Boiling Point: 463 °C at 760 mmHg
• PKA: 4.73±0.10(Predicted)
• Flash Point: 150.6 °C
• PSA: 63.60000
• Density: 0.97 g/cm³
• LogP: 5.65010
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 17
• Exact Mass: 340.26135963
• Heavy Atom Count: 24
• Complexity: 350

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC=CCCCC(=O)OC(CCCC)CCCCC(=O)O
• Isomeric SMILES: CCCC/C=C/CCCC(=O)OC(CCCC)CCCCC(=O)O