Hexadecanedioic Acid

• CAS: 505-54-4
• Catalog Number: ACM-MO-505544
• Category: Polymer/Macromolecule; Dicarboxylic Acid Monomers
• Molecular Weight: 286.41 g/mol
• Molecular Formula: C16H30O4
• Description: Solid
• Synonyms: 1,14-Tetradecanedicarboxylic Acid;; Thapsic Acid
• IUPAC Name: Hexadecanedioic acid
• Canonical SMILES: C(CCCCCCCC(=O)O)CCCCCCC(=O)O
• InChI: InChI=1S/C16H30O4/c17-15(18)13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)20/h1-14H2,(H,17,18)(H,19,20)
• InChI Key: QQHJDPROMQRDLA-UHFFFAOYSA-N
• Boiling Point: 451.08 °C
• Melting Point: 126 °C
• Flash Point: 244.6ºC
• Density: 1.035 g/ml
• Appearance: White to Almost White Powder to Crystal
• Application: This product is suitable for scientific research.
• Storage: Room temperature
• Assay: 96%
• Complexity: 225
• Covalently-Bonded Unit Count: 1
• EC Number: 208-013-5
• Exact Mass: 286.214409g/mol
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• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 20
• HS Code: 2917190090
• LogP: 4.61700
• MDL Number: MFCD00002746
• Monoisotopic Mass: 286.214409g/mol
• NACRES: NA.23
• NSC Number: 15164
• Physical State: Solid
• pKa: 4.48±0.10
• PSA: 74.6
• PubChem ID: 24850364
• Quality Level: 200
• Rotatable Bond Count: 15
• Stability: Stable. Incompatible with bases, oxidizing agents, reducing agents. Combustible.
• UNII: SVZ90045Y2
• WGK Germany: 3
• XLogP3: 5.4