8-methyl-1,4-dioxaspiro[4.4]nonane

C8H14O2 — CID 86135239

IUPAC8-methyl-1,4-dioxaspiro[4.4]nonane
SMILESCC1CCC2(C1)OCCO2
InChIInChI=1S/C8H14O2/c1-7-2-3-8(6-7)9-4-5-10-8/h7H,2-6H2,1H3
InChIKeyACOFEXDORZQHIM-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.55
Rot. Bonds

About 8-methyl-1,4-dioxaspiro[4.4]nonane

8-methyl-1,4-dioxaspiro[4.4]nonane (PubChem CID 86135239) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 8-methyl-1,4-dioxaspiro[4.4]nonane.

Molecular Properties

Compound Name8-methyl-1,4-dioxaspiro[4.4]nonane
PubChem CID86135239
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name8-methyl-1,4-dioxaspiro[4.4]nonane
SMILESCC1CCC2(C1)OCCO2
InChIInChI=1S/C8H14O2/c1-7-2-3-8(6-7)9-4-5-10-8/h7H,2-6H2,1H3
InChIKeyACOFEXDORZQHIM-UHFFFAOYSA-N
XLogP1.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-1,4-dioxaspiro[4.4]nonane?
The IUPAC name of 8-methyl-1,4-dioxaspiro[4.4]nonane (CID 86135239) is 8-methyl-1,4-dioxaspiro[4.4]nonane.
What is the SMILES notation for 8-methyl-1,4-dioxaspiro[4.4]nonane?
The canonical SMILES for 8-methyl-1,4-dioxaspiro[4.4]nonane is CC1CCC2(C1)OCCO2.
What is the InChIKey of 8-methyl-1,4-dioxaspiro[4.4]nonane?
The InChIKey is ACOFEXDORZQHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-7-2-3-8(6-7)9-4-5-10-8/h7H,2-6H2,1H3.
What are the key properties of 8-methyl-1,4-dioxaspiro[4.4]nonane?
8-methyl-1,4-dioxaspiro[4.4]nonane has a molecular weight of 142.20 g/mol, XLogP of 1.55, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1,4-dioxaspiro[4.4]nonane is sourced from PubChem (CID 86135239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).