2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane

C8H14O2 — CID 134986496

IUPAC2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane
SMILESCCC1(C)CC12OCCO2
InChIInChI=1S/C8H14O2/c1-3-7(2)6-8(7)9-4-5-10-8/h3-6H2,1-2H3
InChIKeyOBNJGOKDUHDCKV-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.55
Rot. Bonds1

About 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane

2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane (PubChem CID 134986496) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane.

Molecular Properties

Compound Name2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane
PubChem CID134986496
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane
SMILESCCC1(C)CC12OCCO2
InChIInChI=1S/C8H14O2/c1-3-7(2)6-8(7)9-4-5-10-8/h3-6H2,1-2H3
InChIKeyOBNJGOKDUHDCKV-UHFFFAOYSA-N
XLogP1.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
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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Related Compounds

[1-(2-Methyl-1,3-dioxolan-2-yl)cyclopropyl]methanol
CID 22042312
2-Ethyl-4,7-dioxaspiro[2.4]heptane
CID 131851586
4,5-Difluoro-2,2-dimethyl-4-(2-methylbutan-2-yl)-1,3-dioxolane
CID 117767666
2,2-Dimethyl-4,7-dioxaspiro[2.4]heptane
CID 131851587
1,2-Diethyl-2-methyl-4,7-dioxaspiro[2.4]heptane
CID 134986446
2-Ethyl-1-methyl-4,7-dioxaspiro[2.4]heptane
CID 134986808
1-Ethyl-2,2-dimethyl-4,7-dioxaspiro[2.4]heptane
CID 134986811
Hjpymtrhmrercu-uhfffaoysa-
CID 12613540
4-(2,2-Dimethylpropyl)-2,2-dimethyl-1,3-dioxolane
CID 14582302
2-Methyl-4-(2-methylbutan-2-yl)-1,3-dioxolane
CID 18725500
4-Cyclopropyl-2,2-dimethyl-1,3-dioxolane
CID 21034200
1-(2-Methyl-1,3-dioxolan-2-yl)cyclopropanethanol
CID 22042297

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane?
The IUPAC name of 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane (CID 134986496) is 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane.
What is the SMILES notation for 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane?
The canonical SMILES for 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane is CCC1(C)CC12OCCO2.
What is the InChIKey of 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane?
The InChIKey is OBNJGOKDUHDCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-7(2)6-8(7)9-4-5-10-8/h3-6H2,1-2H3.
What are the key properties of 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane?
2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane has a molecular weight of 142.20 g/mol, XLogP of 1.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-4,7-dioxaspiro[2.4]heptane is sourced from PubChem (CID 134986496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).