(E)-5-(2-carboxyethylsulfanyl)-4-hydroxynonadec-6-enoic acid

Base Information

• Chemical Name: (E)-5-(2-carboxyethylsulfanyl)-4-hydroxynonadec-6-enoic acid
• CAS No.: 95061-94-2
• Molecular Formula: C22H40 O5 S
• Molecular Weight: 0
• Mol file: 95061-94-2.mol

Synonyms:4-hydroxy-5-((2-carboxyethyl)thio)-6-nonadecenoic acid;desamino-2-norleukotriene E1;DN-LTE(1)

Chemical Property of (E)-5-(2-carboxyethylsulfanyl)-4-hydroxynonadec-6-enoic acid

Chemical Property:

• Vapor Pressure: 1.18E-17mmHg at 25°C
• Boiling Point: 614.2°Cat760mmHg
• Flash Point: 325.3°C
• PSA: 120.13000
• Density: 1.077g/cm³
• LogP: 5.65580
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 20
• Exact Mass: 416.25964555
• Heavy Atom Count: 28
• Complexity: 425

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCC=CC(C(CCC(=O)O)O)SCCC(=O)O
• Isomeric SMILES: CCCCCCCCCCCC/C=C/C(C(CCC(=O)O)O)SCCC(=O)O