4-ethenyl-2-(2-methylprop-1-enyl)oxolane

C10H16O — CID 550408

IUPAC4-ethenyl-2-(2-methylprop-1-enyl)oxolane
SMILESC=CC1COC(C=C(C)C)C1
InChIInChI=1S/C10H16O/c1-4-9-6-10(11-7-9)5-8(2)3/h4-5,9-10H,1,6-7H2,2-3H3
InChIKeyFLFATELESFKQNE-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.54
Rot. Bonds2

About 4-ethenyl-2-(2-methylprop-1-enyl)oxolane

4-ethenyl-2-(2-methylprop-1-enyl)oxolane (PubChem CID 550408) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 4-ethenyl-2-(2-methylprop-1-enyl)oxolane.

Molecular Properties

Compound Name4-ethenyl-2-(2-methylprop-1-enyl)oxolane
PubChem CID550408
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name4-ethenyl-2-(2-methylprop-1-enyl)oxolane
SMILESC=CC1COC(C=C(C)C)C1
InChIInChI=1S/C10H16O/c1-4-9-6-10(11-7-9)5-8(2)3/h4-5,9-10H,1,6-7H2,2-3H3
InChIKeyFLFATELESFKQNE-UHFFFAOYSA-N
XLogP2.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3R,4S)-3-propoxy-4-(2-propoxyethyl)cyclopentene
CID 24744770
Marmelo oxide B
CID 14379831
Marmelo oxide A
CID 14379832
(2R)-3-methyl-2-(3-methylbut-2-enyl)-2,5-dihydrofuran
CID 101600448
(2S,5R)-2-ethenyl-2-methyl-5-[(2E)-6-methylhepta-2,5-dien-2-yl]oxolane
CID 162888684
5,6-dihydro-4-methyl-2-(2-methylpropyl)-2H-pyran
CID 108398
4-Methyl-2-(3-methylbuta-1,3-dienyl)oxolane
CID 86247097
(3R,4S)-3-ethoxy-4-(2-ethoxyethyl)cyclopentene
CID 24745088
(3R,4S)-3-butoxy-4-(2-butoxyethyl)cyclopentene
CID 24745089
(2S)-3-methyl-2-(3-methylbut-2-enyl)-2,5-dihydrofuran
CID 101600447
(2S,5S)-2-ethenyl-2-methyl-5-[(2E)-6-methylhepta-2,5-dien-2-yl]oxolane
CID 162888683
(3S)-3-methyl-6-[(5R)-5-(2-methylprop-1-enyl)oxolan-3-ylidene]hex-1-en-3-ol
CID 163081193

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-(2-methylprop-1-enyl)oxolane?
The IUPAC name of 4-ethenyl-2-(2-methylprop-1-enyl)oxolane (CID 550408) is 4-ethenyl-2-(2-methylprop-1-enyl)oxolane.
What is the SMILES notation for 4-ethenyl-2-(2-methylprop-1-enyl)oxolane?
The canonical SMILES for 4-ethenyl-2-(2-methylprop-1-enyl)oxolane is C=CC1COC(C=C(C)C)C1.
What is the InChIKey of 4-ethenyl-2-(2-methylprop-1-enyl)oxolane?
The InChIKey is FLFATELESFKQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-4-9-6-10(11-7-9)5-8(2)3/h4-5,9-10H,1,6-7H2,2-3H3.
What are the key properties of 4-ethenyl-2-(2-methylprop-1-enyl)oxolane?
4-ethenyl-2-(2-methylprop-1-enyl)oxolane has a molecular weight of 152.24 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-(2-methylprop-1-enyl)oxolane is sourced from PubChem (CID 550408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).