10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene

C12H20O2 — CID 15946868

IUPAC10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene
SMILESCOC1=CCCC(C)(C)C12CCCO2
InChIInChI=1S/C12H20O2/c1-11(2)7-4-6-10(13-3)12(11)8-5-9-14-12/h6H,4-5,7-9H2,1-3H3
InChIKeyLMQWAPGEUIELNG-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.89
Rot. Bonds1

About 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene

10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene (PubChem CID 15946868) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene.

Molecular Properties

Compound Name10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene
PubChem CID15946868
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene
SMILESCOC1=CCCC(C)(C)C12CCCO2
InChIInChI=1S/C12H20O2/c1-11(2)7-4-6-10(13-3)12(11)8-5-9-14-12/h6H,4-5,7-9H2,1-3H3
InChIKeyLMQWAPGEUIELNG-UHFFFAOYSA-N
XLogP2.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6,6,10-Trimethyl-1-oxaspiro[4.5]dec-9-ene
CID 14086334
4-Methoxy-1-oxaspiro[4.5]dec-3-ene
CID 13300108
6-Methoxy-1-oxaspiro[4.5]dec-6-ene
CID 15946867
2-ethyl-1-[(Z)-1-methoxybut-1-enyl]-3,6,6-trimethyl-7-oxabicyclo[2.2.1]hept-2-ene
CID 145801954
trimethyl-[[(2S,5R)-2,6,6-trimethyl-1-oxaspiro[4.5]dec-9-en-10-yl]oxy]silane
CID 10516078
(1S,4S,5R)-3-methoxyspiro[bicyclo[3.2.1]oct-2-ene-4,2'-oxolane]
CID 15946869

Frequently Asked Questions

What is the IUPAC name of 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene?
The IUPAC name of 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene (CID 15946868) is 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene.
What is the SMILES notation for 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene?
The canonical SMILES for 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene is COC1=CCCC(C)(C)C12CCCO2.
What is the InChIKey of 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene?
The InChIKey is LMQWAPGEUIELNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-11(2)7-4-6-10(13-3)12(11)8-5-9-14-12/h6H,4-5,7-9H2,1-3H3.
What are the key properties of 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene?
10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene has a molecular weight of 196.29 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methoxy-6,6-dimethyl-1-oxaspiro[4.5]dec-9-ene is sourced from PubChem (CID 15946868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).