10-[2-(4-Oxatetracyclo[6.2.1.02,7.03,5]undecan-10-yloxy)ethoxy]-4-oxatetracyclo[6.2.1.02,7.03,5]undecane
Basic information
- CAS
5146-81-6- Standard SMILES
C(COC1CC2CC1C1C2CC2OC21)OC1CC2CC1C1C2CC2OC21- InChIKey
HRUIRWVQYBQBJX-UHFFFAOYSA-N- Molecular formula
- C22H30O4
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.21440943
Names & identifiers
- Preferred name
- 10-[2-(4-Oxatetracyclo[6.2.1.02,7.03,5]undecan-10-yloxy)ethoxy]-4-oxatetracyclo[6.2.1.02,7.03,5]undecane
- IUPAC
- 10-[2-(4-oxatetracyclo[6.2.1.02,7.03,5]undecan-10-yloxy)ethoxy]-4-oxatetracyclo[6.2.1.02,7.03,5]undecane
Names & synonyms
MLS0027037165146-81-6NSC 102314NSC102314CHEMBL1884263SCHEMBL13403138DTXSID50295489NSC-102314SMR0015704333,3'-[Ethane-1,2-diylbis(oxy)]di(octahydro-1aH-2,5-methanoindeno[1,2-b]oxirene)
Database identifiers
- CAS
5146-81-6- PubChem CID
- 265807
- DTXSID
DTXSID50295489- ChEMBL
CHEMBL1884263
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 43.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 584
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Compound notes
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