1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane

C10H18O — CID 544882

IUPAC1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane
SMILESCC(C)=C1CC1OC(C)(C)C
InChIInChI=1S/C10H18O/c1-7(2)8-6-9(8)11-10(3,4)5/h9H,6H2,1-5H3
InChIKeyDDZQYTIGYXBZPG-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.91
Rot. Bonds1

About 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane

1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane (PubChem CID 544882) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane.

Molecular Properties

Compound Name1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane
PubChem CID544882
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane
SMILESCC(C)=C1CC1OC(C)(C)C
InChIInChI=1S/C10H18O/c1-7(2)8-6-9(8)11-10(3,4)5/h9H,6H2,1-5H3
InChIKeyDDZQYTIGYXBZPG-UHFFFAOYSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane?
The IUPAC name of 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane (CID 544882) is 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane.
What is the SMILES notation for 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane?
The canonical SMILES for 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane is CC(C)=C1CC1OC(C)(C)C.
What is the InChIKey of 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane?
The InChIKey is DDZQYTIGYXBZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-7(2)8-6-9(8)11-10(3,4)5/h9H,6H2,1-5H3.
What are the key properties of 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane?
1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane has a molecular weight of 154.25 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylpropan-2-yl)oxy]-2-propan-2-ylidenecyclopropane is sourced from PubChem (CID 544882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).