3-Hydroxy-1-methylpropyl nonan-1-oate

Base Information

• Chemical Name: 3-Hydroxy-1-methylpropyl nonan-1-oate
• CAS No.: 89457-52-3
• Molecular Formula: C13H26 O3
• Molecular Weight: 230.34374
• European Community (EC) Number: 289-503-6
• DSSTox Substance ID: DTXSID50869023
• Nikkaji Number: J348.595A
• Mol file: 89457-52-3.mol

Synonyms:89457-52-3;3-Hydroxy-1-methylpropyl nonan-1-oate;EINECS 289-503-6;DTXSID50869023;ODCLBFHKYXZZSM-UHFFFAOYSA-N;4-HYDROXYBUTAN-2-YL NONANOATE;NS00064894

Chemical Property of 3-Hydroxy-1-methylpropyl nonan-1-oate

Chemical Property:

• Vapor Pressure: 2.2E-05mmHg at 25°C
• Boiling Point: 322.6°C at 760 mmHg
• Flash Point: 123.9°C
• PSA: 46.53000
• Density: 0.94g/cm³
• LogP: 3.05110
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 11
• Exact Mass: 230.18819469
• Heavy Atom Count: 16
• Complexity: 169

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(=O)OC(C)CCO