Basic information
- CAS
93633-24-0- Standard SMILES
CCCCCC(C)(C)c1ccc(OCCOCCO)cc1- InChIKey
MPOLWKREQBPNLC-UHFFFAOYSA-N- Molecular formula
- C18H30O3
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.21949481
Names & identifiers
- Preferred name
- 2-(2-(4-(2-Methylheptan-2-yl)phenoxy)ethoxy)ethanol
- IUPAC
- 2-[2-[4-(2-methylheptan-2-yl)phenoxy]ethoxy]ethanol
Names & synonyms
93633-24-02-(2-(4-(2-Methylheptan-2-yl)phenoxy)ethoxy)ethanolSCHEMBL9299799DTXSID002394942-{2-[4-(2-Methylheptan-2-yl)phenoxy]ethoxy}ethan-1-ol
Database identifiers
- CAS
93633-24-0- PubChem CID
- 185282
- DTXSID
DTXSID00239494
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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