2,4,6-Octatrienoic acid

Base Information

• Chemical Name: 2,4,6-Octatrienoic acid
• CAS No.: 97329-94-7
• Molecular Formula: C8H10O2
• Molecular Weight: 138.166
• European Community (EC) Number: 622-483-2
• UNII: 702XZO95X4
• DSSTox Substance ID: DTXSID20242869
• Nikkaji Number: J1.100.542J,J2.629.767B
• ChEMBL ID: CHEMBL1208330
• Mol file: 97329-94-7.mol

Synonyms:2,4,6-octatrienoic acid;LGD1550;octa-2,4,6-trienoic acid

Chemical Property of 2,4,6-Octatrienoic acid

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 138.068079557
• Heavy Atom Count: 10
• Complexity: 176

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC=CC=CC=CC(=O)O
• Isomeric SMILES: C/C=C/C=C/C=C/C(=O)O