2-ethyl-2-propyloxane

C10H20O — CID 154667822

IUPAC2-ethyl-2-propyloxane
SMILESCCCC1(CC)CCCCO1
InChIInChI=1S/C10H20O/c1-3-7-10(4-2)8-5-6-9-11-10/h3-9H2,1-2H3
InChIKeyBNAQUSAPQQSTFW-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.14
Rot. Bonds3

About 2-ethyl-2-propyloxane

2-ethyl-2-propyloxane (PubChem CID 154667822) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-ethyl-2-propyloxane.

Molecular Properties

Compound Name2-ethyl-2-propyloxane
PubChem CID154667822
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-ethyl-2-propyloxane
SMILESCCCC1(CC)CCCCO1
InChIInChI=1S/C10H20O/c1-3-7-10(4-2)8-5-6-9-11-10/h3-9H2,1-2H3
InChIKeyBNAQUSAPQQSTFW-UHFFFAOYSA-N
XLogP3.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-propyloxane?
The IUPAC name of 2-ethyl-2-propyloxane (CID 154667822) is 2-ethyl-2-propyloxane.
What is the SMILES notation for 2-ethyl-2-propyloxane?
The canonical SMILES for 2-ethyl-2-propyloxane is CCCC1(CC)CCCCO1.
What is the InChIKey of 2-ethyl-2-propyloxane?
The InChIKey is BNAQUSAPQQSTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-7-10(4-2)8-5-6-9-11-10/h3-9H2,1-2H3.
What are the key properties of 2-ethyl-2-propyloxane?
2-ethyl-2-propyloxane has a molecular weight of 156.27 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-propyloxane is sourced from PubChem (CID 154667822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).