CID 175950

Base Information

• Chemical Name: CID 175950
• CAS No.: 103733-68-2
• Molecular Weight: 548.6219
• Mol file: 103733-68-2.mol

Synonyms:103733-68-2;2-benzofuran-1,3-dione;benzoic acid;2-ethylhexanoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;C8-H16-O2.x-(C8H4-O3.C6-H14-O3)x-.x-C7-H6-O2

Chemical Property of CID 175950

Chemical Property:

• Vapor Pressure: 0.00157mmHg at 25°C
• Boiling Point: 295°Cat760mmHg
• Flash Point: 139.7°C
• PSA: 178.66000
• Density: g/cm³
• LogP: 4.02910
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 10
• Exact Mass: 548.26214747
• Heavy Atom Count: 39
• Complexity: 451

Purity/Quality:

99.0%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)C(=O)O.CCC(CO)(CO)CO.C1=CC=C(C=C1)C(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O