Basic information
- CAS
75248-95-2- Standard SMILES
CCCCC(CC)COC(=O)C(C)c1cc(C)c(O)c(C(C)(C)C)c1- InChIKey
SAEBMUYQRYILIX-UHFFFAOYSA-N- Molecular formula
- C22H36O3
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.26644501
Names & identifiers
- Preferred name
- 2-Ethylhexyl 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate
- IUPAC
- 2-ethylhexyl 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate
Names & synonyms
75248-95-2Propanoic acid, 2(or 3)-(3-(1,1-dimethylethyl)-4-hydroxy-5-methylphenyl)-, 2-ethylhexyl ester2-ethylhexyl 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoateSCHEMBL284593DTXSID30996725
Database identifiers
- CAS
75248-95-2- PubChem CID
- 3036697
- DTXSID
DTXSID30996725
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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