1-butoxypropan-2-yl (Z)-octadec-9-enoate

Base Information

• Chemical Name: 1-butoxypropan-2-yl (Z)-octadec-9-enoate
• CAS No.: 37281-78-0
• Molecular Formula: (C3H6 O)n C22 H42 O2
• Molecular Weight: 396.64682
• European Community (EC) Number: 694-934-1
• Mol file: 37281-78-0.mol

Synonyms:37281-78-0;SCHEMBL789278;(C3-H6-O)mult-C22-H42-O2

Chemical Property of 1-butoxypropan-2-yl (Z)-octadec-9-enoate

Chemical Property:

• Vapor Pressure: 4.44E-09mmHg at 25°C
• Refractive Index: 1.457
• Boiling Point: 472°Cat760mmHg
• Flash Point: 172.2°C
• PSA: 35.53000
• Density: 0.891g/cm³
• LogP: 7.77230
• XLogP3: 9.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 22
• Exact Mass: 396.36034539
• Heavy Atom Count: 28
• Complexity: 352

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OC(C)COCCCC
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OC(C)COCCCC