Basic information
- Standard SMILES
COCC(=O)OCC(C)(C)OC(C)C1CCCC(C)(C)C1- InChIKey
QRMIMOONEMNNFI-UHFFFAOYSA-N- Molecular formula
- C17H32O4
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.2300595
Names & identifiers
- Preferred name
- Methoxyacetic acid-2-[1-(3,3-dimethyl-cyclohexyl)-ethoxy]-2-methyl-propyl ester
- IUPAC
- [2-[1-(3,3-dimethylcyclohexyl)ethoxy]-2-methylpropyl] 2-methoxyacetate
Names & synonyms
SCHEMBL2728657QRMIMOONEMNNFI-UHFFFAOYSA-Nmethoxyacetic acid-2-[1-(3,3-dimethyl-cyclohexyl)-ethoxy]-2-methyl-propyl ester
Database identifiers
- PubChem CID
- 50996019
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 336
Related reactions
1 records
Compound notes
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