2-Ethyl-2-((4-hydroxybutoxy)methyl)propane-1,3-diol

Base Information

• Chemical Name: 2-Ethyl-2-((4-hydroxybutoxy)methyl)propane-1,3-diol
• CAS No.: 81125-12-4
• Molecular Formula: C10H22 O4
• Molecular Weight: 206.27928
• European Community (EC) Number: 279-693-9
• UNII: XEE5L2WD5V
• DSSTox Substance ID: DTXSID001001798
• Nikkaji Number: J296.070B
• Wikidata: Q82995805
• Mol file: 81125-12-4.mol

Synonyms:81125-12-4;XEE5L2WD5V;EINECS 279-693-9;2-Ethyl-2-((4-hydroxybutoxy)methyl)propane-1,3-diol;UNII-XEE5L2WD5V;2-Ethyl-2-((4-hydroxybutoxy)methyl)-1,3-propanediol;2-ETHYL-2-[(4-HYDROXYBUTOXY)METHYL]PROPANE-1,3-DIOL;2-Ethyl-2-[(4-hydroxybutoxy)methyl]-1,3-propanediol;SCHEMBL8087527;DTXSID001001798;1,3-PROPANEDIOL, 2-ETHYL-2-((4-HYDROXYBUTOXY)METHYL)-

Chemical Property of 2-Ethyl-2-((4-hydroxybutoxy)methyl)propane-1,3-diol

Chemical Property:

• Vapor Pressure: 6.34E-07mmHg at 25°C
• Boiling Point: 368.4°C at 760 mmHg
• Flash Point: 176.6°C
• PSA: 69.92000
• Density: 1.071g/cm³
• LogP: 0.15650
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 206.15180918
• Heavy Atom Count: 14
• Complexity: 123

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CO)(CO)COCCCCO