2-ethoxy-2-methylbutane

C7H16O — CID 13527

IUPAC2-ethoxy-2-methylbutane
SMILESCCOC(C)(C)CC
InChIInChI=1S/C7H16O/c1-5-7(3,4)8-6-2/h5-6H2,1-4H3
InChIKeyKFRVYYGHSPLXSZ-UHFFFAOYSA-N
MW116.20 g/mol
LogP2.21
Rot. Bonds3

About 2-ethoxy-2-methylbutane

2-ethoxy-2-methylbutane (PubChem CID 13527) has the molecular formula C7H16O and a molecular weight of 116.20 g/mol. Its IUPAC name is 2-ethoxy-2-methylbutane.

Molecular Properties

Compound Name2-ethoxy-2-methylbutane
PubChem CID13527
Molecular FormulaC7H16O
Molecular Weight116.20 g/mol
Exact Mass116.12
IUPAC Name2-ethoxy-2-methylbutane
SMILESCCOC(C)(C)CC
InChIInChI=1S/C7H16O/c1-5-7(3,4)8-6-2/h5-6H2,1-4H3
InChIKeyKFRVYYGHSPLXSZ-UHFFFAOYSA-N
XLogP2.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.20
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Ethyl tert-butyl ether
CID 12512
Tert-Amyl methyl ether
CID 61247
Propane, 2-methyl-2-(1-methylethoxy)-
CID 28488
Isopropyl tert-butyl ether
CID 118384
2-(1,1-Dimethylethoxy)butane
CID 36292
1-Tert-butoxybutane
CID 136788
Propyl tert-butyl ether
CID 520405
2-(Methoxy-d3)-2-methylbutane
CID 71309614
Butyl 1,1-dimethylpropyl ether
CID 520577
1,1-Dimethylethyl 3-methylbutyl ether
CID 21894291
Ethyl-isopropyl ether
CID 11457832
2-Methoxy-2-(~13~C)methyl(1,4-~13~C_2_)butane
CID 71308924

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-methylbutane?
The IUPAC name of 2-ethoxy-2-methylbutane (CID 13527) is 2-ethoxy-2-methylbutane.
What is the SMILES notation for 2-ethoxy-2-methylbutane?
The canonical SMILES for 2-ethoxy-2-methylbutane is CCOC(C)(C)CC.
What is the InChIKey of 2-ethoxy-2-methylbutane?
The InChIKey is KFRVYYGHSPLXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O/c1-5-7(3,4)8-6-2/h5-6H2,1-4H3.
What are the key properties of 2-ethoxy-2-methylbutane?
2-ethoxy-2-methylbutane has a molecular weight of 116.20 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-methylbutane is sourced from PubChem (CID 13527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).