Ethohexadiol (C8H18O2)

Looking for routes to Ethohexadiol? Ethohexadiol presents a C8 framework, alcohol functionality. Use the planner with prefilled SMILES, or copy CCCC(O)C(CC)CO (CAS 94-96-2).

Target: Ethohexadiol
CAS: 94-96-2
Formula: C8H18O2
Approx. MW: 146.23
SMILES: CCCC(O)C(CC)CO
PubChem CID: 7211
Approx. carbons: C8

Ethohexadiol structure

Properties

IUPAC name: 2-ethylhexane-1,3-diol
Common names: 2-ETHYL-1,3-HEXANEDIOL; 94-96-2; Ethohexadiol; 1,3-Hexanediol, 2-ethyl-; Repellent 612; Rutgers 612; Carbide 6-12; 6-12 insect repellent; 2-Ethyl-1,3-hexylene glycol; 2-Ethyl-3-propyl-1,3-propanediol
Molecular weight: 146.23
Exact mass: 146.13
InChIKey: RWLALWYNXFYRGW-UHFFFAOYSA-N
Melting point: -40 °C
Boiling point: 244.2 °C @ 760 MM HG
Density: 0.9325 @ 22 °C/4 °C

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Ethohexadiol 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Ethohexadiol?

Ethohexadiol has molecular formula C8H18O2. Molecular weight about 146.23 g·mol⁻¹.

What is the CAS number of Ethohexadiol?

The CAS Registry Number for Ethohexadiol is 94-96-2.

Run AI retrosynthesis for Ethohexadiol Target catalog AI tools overview

One click loads Ethohexadiol into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

TMPD (alcohol)1-octanol 1-Octyn-3-Ol 2-Ethylhexan-1-ol 3-Ethyl-2-methyl-3-pentanol 3-Methyl-1-heptanol

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.