Basic information
- Standard SMILES
O=C=Nc1ccc(OCCOCCOCCOCCOCCOC2CCCCO2)cc1- InChIKey
SKRDFTWOWFQJQP-UHFFFAOYSA-N- Molecular formula
- C22H33NO8
- Average molar mass
- 439.5 g/mol
Names & identifiers
- Preferred name
- 2-(14-(4-Isocyanatophenoxy)-3,6,9,12-tetraoxatetradecyloxy)tetrahydro-2H-pyran
- IUPAC
- 2-[2-[2-[2-[2-[2-(4-isocyanatophenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]oxane
Names & synonyms
SCHEMBL15436998SKRDFTWOWFQJQP-UHFFFAOYSA-N2-(14-(4-Isocyanatophenoxy)-3,6,9,12-tetraoxatetradecyloxy)tetrahydro-2H-pyran
Database identifiers
- PubChem CID
- 86709889
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 18
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 466
Related reactions
1 records
Compound notes
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