8,11-dioxaspiro[5.6]dodec-9-ene

C10H16O2 — CID 14597951

IUPAC8,11-dioxaspiro[5.6]dodec-9-ene
SMILESC1=COCC2(CCCCC2)CO1
InChIInChI=1S/C10H16O2/c1-2-4-10(5-3-1)8-11-6-7-12-9-10/h6-7H,1-5,8-9H2
InChIKeyXDOLZFBRGNNKTJ-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.45
Rot. Bonds

About 8,11-dioxaspiro[5.6]dodec-9-ene

8,11-dioxaspiro[5.6]dodec-9-ene (PubChem CID 14597951) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 8,11-dioxaspiro[5.6]dodec-9-ene.

Molecular Properties

Compound Name8,11-dioxaspiro[5.6]dodec-9-ene
PubChem CID14597951
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name8,11-dioxaspiro[5.6]dodec-9-ene
SMILESC1=COCC2(CCCCC2)CO1
InChIInChI=1S/C10H16O2/c1-2-4-10(5-3-1)8-11-6-7-12-9-10/h6-7H,1-5,8-9H2
InChIKeyXDOLZFBRGNNKTJ-UHFFFAOYSA-N
XLogP2.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8,11-dioxaspiro[5.6]dodec-9-ene?
The IUPAC name of 8,11-dioxaspiro[5.6]dodec-9-ene (CID 14597951) is 8,11-dioxaspiro[5.6]dodec-9-ene.
What is the SMILES notation for 8,11-dioxaspiro[5.6]dodec-9-ene?
The canonical SMILES for 8,11-dioxaspiro[5.6]dodec-9-ene is C1=COCC2(CCCCC2)CO1.
What is the InChIKey of 8,11-dioxaspiro[5.6]dodec-9-ene?
The InChIKey is XDOLZFBRGNNKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-2-4-10(5-3-1)8-11-6-7-12-9-10/h6-7H,1-5,8-9H2.
What are the key properties of 8,11-dioxaspiro[5.6]dodec-9-ene?
8,11-dioxaspiro[5.6]dodec-9-ene has a molecular weight of 168.24 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,11-dioxaspiro[5.6]dodec-9-ene is sourced from PubChem (CID 14597951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).