(9Z)-Octadec-9-enoic acid--propane-1,2,3-triol (1/6)

Base Information

• Chemical Name: (9Z)-Octadec-9-enoic acid--propane-1,2,3-triol (1/6)
• CAS No.: 79665-92-2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID50703817
• Mol file: 79665-92-2.mol

Synonyms:DTXSID50703817;(9Z)-Octadec-9-enoic acid--propane-1,2,3-triol (1/6)

Chemical Property of (9Z)-Octadec-9-enoic acid--propane-1,2,3-triol (1/6)

Chemical Property:

• PSA: 401.44000
• LogP: -3.90010
• Hydrogen Bond Donor Count: 19
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 27
• Exact Mass: 834.53994500
• Heavy Atom Count: 56
• Complexity: 259

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O