1,10-Decanediol

• Catalog Number: ACM112470
• Product Name: 1,10-Decanediol
• CAS: 112-47-0
• Category: Heterocyclic Organic Compound
• Synonyms: Decane-1,10-Diol
• IUPAC Name: decane-1,10-diol
• Molecular Weight: 174.28
• Molecular Formula: C10H22O2
• Canonical SMILES: C(CCCCCO)CCCCO
• InChI: InChI=1S/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2
• InChI Key: FOTKYAAJKYLFFN-UHFFFAOYSA-N
• Boiling Point: 297 °C at 760 mmHg
• Melting Point: 70-73 °C
• Flash Point: 141.7±13.6 °C
• Density: 0.9±0.1 g/cm3
• Appearance: white powder
• Complexity: 64
• Defined Atom Stereocenter Count: 0
• Exact Mass: 174.1619
• Formal Charge: 0
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 2
• Isotope Atom Count: 0
• Monoisotopic Mass: 174.1619
• Physical State: Solid
• Refractive Index: 1.458
• Rotatable Bond Count: 9
• Topological Polar Surface Area: 40.5 Ų