Ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate
Basic information
- Standard SMILES
CCOC(=O)C(C)(C)CCCCC(c1ccccc1)c1c(C)c(OC)c(C)c(C)c1OC- InChIKey
HUTXBSQHBUSHOU-UHFFFAOYSA-N- Molecular formula
- C28H40O4
- Average molar mass
- 440.6 g/mol
Names & identifiers
- Preferred name
- Ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate
- IUPAC
- ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate
Names & synonyms
SCHEMBL9310950HUTXBSQHBUSHOU-UHFFFAOYSA-Nethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate
Database identifiers
- PubChem CID
- 19088026
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 554
Related reactions
7 records
Compound notes
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