12-Iodo-9-octadecenoic acid

Base Information

• Chemical Name: 12-Iodo-9-octadecenoic acid
• CAS No.: 116784-49-7
• Molecular Formula: C18H33 I O2
• Molecular Weight: 408.36
• Nikkaji Number: J642.726J
• Mol file: 116784-49-7.mol

Synonyms:12-IODE;12-iodo-9-octadecenoic acid

Chemical Property of 12-Iodo-9-octadecenoic acid

Chemical Property:

• Vapor Pressure: 2E-08mmHg at 25°C
• Boiling Point: 425.3°Cat760mmHg
• Flash Point: 211°C
• PSA: 37.30000
• Density: 1.225g/cm³
• LogP: 6.52200
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 408.15253
• Heavy Atom Count: 21
• Complexity: 264

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CC=CCCCCCCCC(=O)O)I
• Isomeric SMILES: CCCCCCC(C/C=C\CCCCCCCC(=O)O)I