1,2-Octanediol

• CAS: 1117-86-8
• Catalog Number: ACM1117868
• Category: Other Products
• Molecular Weight: 146.23
• Molecular Formula: C8H18O2
• Synonyms: Octane-1,2-Diol
• IUPAC Name: octane-1,2-diol
• Canonical SMILES: CCCCCCC(CO)O
• InChI: InChI=1S/C8H18O2/c1-2-3-4-5-6-8(10)7-9/h8-10H,2-7H2,1H3
• InChI Key: AEIJTFQOBWATKX-UHFFFAOYSA-N
• Boiling Point: 243 °C at 760 mmHg
• Melting Point: 36-38 °C(lit.)
• Flash Point: 109.1±13.0 °C
• Density: 0.9±0.1 g/cm3
• Appearance: White powder
• Active Content: 95%
• Hazard Statements: Xi
• Physical State: Solid
• Refractive Index: 1.453
• Safety Description: 37/39-26
• Supplemental Hazard Statements: H319
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 1,2-Octanediol?

The molecular formula of 1,2-Octanediol is C8H18O2.

What are the synonyms for 1,2-Octanediol?

Some synonyms for 1,2-Octanediol are octane-1,2-diol, 1,2-Dihydroxyoctane, and caprylyl glycol.

When was the PubChem CID for 1,2-Octanediol created?

The PubChem CID for 1,2-Octanediol was created on March 26, 2005.

What is the molecular weight of 1,2-Octanediol?

The molecular weight of 1,2-Octanediol is 146.23 g/mol.

What is the IUPAC name of 1,2-Octanediol?

The IUPAC name of 1,2-Octanediol is octane-1,2-diol.

What is the InChIKey of 1,2-Octanediol?

The InChIKey of 1,2-Octanediol is AEIJTFQOBWATKX-UHFFFAOYSA-N.

What is the Canonical SMILES of 1,2-Octanediol?

The Canonical SMILES of 1,2-Octanediol is CCCCCCC(CO)O.

What is the XLogP3 value of 1,2-Octanediol?

The XLogP3 value of 1,2-Octanediol is 1.8.

How many hydrogen bond donor counts does 1,2-Octanediol have?

1,2-Octanediol has 2 hydrogen bond donor counts.

What is the topological polar surface area of 1,2-Octanediol?

The topological polar surface area of 1,2-Octanediol is 40.5 Å2.