2,6-Dimethyl-4-(2-ethyl)hexyloxycarbonylethylphenol
Basic information
- CAS
75248-98-5- Standard SMILES
CCCCC(CC)COC(=O)C(C)c1cc(C)c(O)c(C)c1- InChIKey
WWZGHRHKXHBQPF-UHFFFAOYSA-N- Molecular formula
- C19H30O3
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.21949481
Names & identifiers
- Preferred name
- 2,6-Dimethyl-4-(2-ethyl)hexyloxycarbonylethylphenol
- IUPAC
- 2-ethylhexyl 2-(4-hydroxy-3,5-dimethylphenyl)propanoate
Names & synonyms
75248-98-52,6-Dimethyl-4-(2-ethyl)hexyloxycarbonylethylphenolPropanoic acid, 2(or 3)-(4-hydroxy-3,5-dimethylphenyl)-, 2-ethylhexyl ester2-ethylhexyl 2-(4-hydroxy-3,5-dimethylphenyl)propanoateDTXSID90996726
Database identifiers
- CAS
75248-98-5- PubChem CID
- 3036698
- DTXSID
DTXSID90996726
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 317
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Compound notes
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