Hexyl 2-methylbutyrate

Hexyl 2-methylbutyrate is a chemical compound registered under number CAS 10032-15-2, with the molecular formula C₁₁H₂₂O₂, and a molar mass of 186.29 g/mol.

The molecule contains 35 atoms connected by 34 chemical bonds. The full systematic IUPAC name of this compound is hexyl 2-methylbutanoate. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 3.8 (positive value, a lipophilic compound), polar surface area PSA = 26.3 Ų, 0 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Molecular formula	C11H22O2
Molar mass	186.29 g/mol
IUPAC	hexyl 2-methylbutanoate
SMILES	CCCCCCOC(=O)C(C)CC
InChIKey	YUECNVSODFDKOQ-UHFFFAOYSA-N
logP (XLogP3)	3.8
PSA	26.3 Ų
HBD / HBA	0 / 2
PubChem CID	CID 24838 ↗

Signal word: Warning

H226 — Flammable liquid and vapour

H411 — Toxic to aquatic life with long lasting effects

Hexyl 2-methylbutanoate · 10032-15-2 · Hexyl 2-methylbutyrate · Butanoic acid, 2-methyl-, hexyl ester · BUTYRIC ACID, 2-METHYL-, HEXYL ESTER · FEMA No. 3499 · 2-Methylbutanoic acid, n-hexyl ester · Hexyl 2-methylbutanoate (natural) · EINECS 233-106-2 · UI17LL5Q4P · BRN 1856407 · AI3-33623 · DTXCID2027599 · N-HEXYL 2-METHYLBUTYRATE · HEXYL 2-METHYLBUTYRATE [FCC]

• 📊 PubChem CID 24838 — NIH
• 🔬 NIST WebBook — spectroscopy
• 💊 ChEMBL — bioactivity