Heneicosanoic Acid

• CAS: 2363-71-5
• Catalog Number: ACM2363715
• Category: Other Products; Fatty Acids and Ester Homologs
• Molecular Weight: 326.56
• Molecular Formula: C21H42O2
• Description: Solid
• Synonyms: Heneicosylic acid
• IUPAC Name: henicosanoic acid
• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)O
• InChI: InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)
• InChI Key: CKDDRHZIAZRDBW-UHFFFAOYSA-N
• Melting Point: 74-75 °C (lit.)
• Appearance: Solid
• Storage: Room temperature
• CNo.Chain: C21:0
• Complexity: 238
• Compound Derivative: Acid
• Covalently-Bonded Unit Count: 1
• EC Number: 219-113-3
• Exact Mass: 326.318481g/mol
• Fatty Acid: Heneicosanoic
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Heavy Atom Count: 23
• Monoisotopic Mass: 326.318481g/mol
• Physical State: Solid
• Rotatable Bond Count: 19
• UNII: NRY04FUK8H
• XLogP3: 9.1