2,2-Dimethylpropyl propanoate structure

2,2-Dimethylpropyl propanoate

2,2-dimethylpropyl propanoate

Also Known As: neopentyl propionate|2,2-dimethylpropyl propanoate|propionic acid neopentyl ester|1-Propanol, 2,2-dimethyl-, propanoate|2,2-Dimethyl-1-propanol propionate|2,2-Dimethyl1-propanol propanoate|1-Propanol,2-dimethyl-, propanoate|1-Propanol,2-dimethyl-, propionate|Propionic acid 2,2-dimethylpropyl ester|1-Propanol, 2,2-dimethyl-, propionate

CAS: 40530-20-9
Molecular Formula C8H16O2
Molecular Weight 144.11504 g/mol
LogP 2.6
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 4
Exact Mass 144.11504
Monoisotopic Mass 144.11504
Heavy Atoms 10
Complexity 111.0

Chemical Identifiers

CAS Number 40530-20-9
SMILES CCC(=O)OCC(C)(C)C
InChIKey UQNDRPKPYHCNNN-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (8 patents) Heterocyclic Building Blocks (14 patents) Organic Building Blocks (24 patents) Organometallic Reagents (1 patents) Pharmaceutical Intermediates (12 patents) Polymer Intermediates (14 patents)

Product Overview

2,2-Dimethylpropyl propanoate (CAS 40530-20-9), with molecular formula C8H16O2 and molecular weight 144.11504 g/mol. IUPAC: 2,2-dimethylpropyl propanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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