D-Gluconic acid N-oleyl-1,3-propanediamine salt (1:1)

Base Information

• Chemical Name: D-Gluconic acid N-oleyl-1,3-propanediamine salt (1:1)
• CAS No.: 83542-86-3
• Molecular Formula: C27H56N2O7
• Molecular Weight: 520.74274
• UNII: MS9T9E6DTF
• DSSTox Substance ID: DTXSID00896804
• Wikidata: Q27284211
• Mol file: 83542-86-3.mol

Synonyms:Oleylaminopropylamine gluconate;D-Gluconic acid N-oleyl-1,3-propanediamine salt (1:1);UNII-MS9T9E6DTF;MS9T9E6DTF;83542-86-3;D-Gluconic acid N-oleyl-1,3-propanediamine salt;1,3-Propanediamine, N-9-octadecenyl-, (Z)-, mono-D-gluconate;N-cis-9-Octadecenyl-1,3-propanediamine monogluconate;DTXSID00896804;C21H44N2.C6H12O7;LS-71450;C21-H44-N2.C6-H12-O7;Q27284211

Chemical Property of D-Gluconic acid N-oleyl-1,3-propanediamine salt (1:1)

Chemical Property:

• Vapor Pressure: 8.66E-08mmHg at 25°C
• Boiling Point: 435.6°C at 760 mmHg
• Flash Point: 257.5°C
• PSA: 176.50000
• LogP: 3.56040
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 24
• Exact Mass: 520.40875213
• Heavy Atom Count: 36
• Complexity: 396

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCCNCCCN.C(C(C(C(C(C(=O)O)O)O)O)O)O
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCCNCCCN.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O