2-(2-methylprop-2-enoxy)ethylidenecyclopropane

C9H14O — CID 135083788

IUPAC2-(2-methylprop-2-enoxy)ethylidenecyclopropane
SMILESC=C(C)COCC=C1CC1
InChIInChI=1S/C9H14O/c1-8(2)7-10-6-5-9-3-4-9/h5H,1,3-4,6-7H2,2H3
InChIKeyFPFMEGZOPSYCFT-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.30
Rot. Bonds4

About 2-(2-methylprop-2-enoxy)ethylidenecyclopropane

2-(2-methylprop-2-enoxy)ethylidenecyclopropane (PubChem CID 135083788) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-(2-methylprop-2-enoxy)ethylidenecyclopropane.

Molecular Properties

Compound Name2-(2-methylprop-2-enoxy)ethylidenecyclopropane
PubChem CID135083788
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name2-(2-methylprop-2-enoxy)ethylidenecyclopropane
SMILESC=C(C)COCC=C1CC1
InChIInChI=1S/C9H14O/c1-8(2)7-10-6-5-9-3-4-9/h5H,1,3-4,6-7H2,2H3
InChIKeyFPFMEGZOPSYCFT-UHFFFAOYSA-N
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-2-enoxy)ethylidenecyclopropane?
The IUPAC name of 2-(2-methylprop-2-enoxy)ethylidenecyclopropane (CID 135083788) is 2-(2-methylprop-2-enoxy)ethylidenecyclopropane.
What is the SMILES notation for 2-(2-methylprop-2-enoxy)ethylidenecyclopropane?
The canonical SMILES for 2-(2-methylprop-2-enoxy)ethylidenecyclopropane is C=C(C)COCC=C1CC1.
What is the InChIKey of 2-(2-methylprop-2-enoxy)ethylidenecyclopropane?
The InChIKey is FPFMEGZOPSYCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O/c1-8(2)7-10-6-5-9-3-4-9/h5H,1,3-4,6-7H2,2H3.
What are the key properties of 2-(2-methylprop-2-enoxy)ethylidenecyclopropane?
2-(2-methylprop-2-enoxy)ethylidenecyclopropane has a molecular weight of 138.21 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-2-enoxy)ethylidenecyclopropane is sourced from PubChem (CID 135083788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).