6-ethenyl-2,2,3-trimethyloxane

C10H18O — CID 69493428

IUPAC6-ethenyl-2,2,3-trimethyloxane
SMILESC=CC1CCC(C)C(C)(C)O1
InChIInChI=1S/C10H18O/c1-5-9-7-6-8(2)10(3,4)11-9/h5,8-9H,1,6-7H2,2-4H3
InChIKeyFTXYUQUQKVCREF-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds1

About 6-ethenyl-2,2,3-trimethyloxane

6-ethenyl-2,2,3-trimethyloxane (PubChem CID 69493428) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6-ethenyl-2,2,3-trimethyloxane.

Molecular Properties

Compound Name6-ethenyl-2,2,3-trimethyloxane
PubChem CID69493428
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6-ethenyl-2,2,3-trimethyloxane
SMILESC=CC1CCC(C)C(C)(C)O1
InChIInChI=1S/C10H18O/c1-5-9-7-6-8(2)10(3,4)11-9/h5,8-9H,1,6-7H2,2-4H3
InChIKeyFTXYUQUQKVCREF-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
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

2,6,6-Trimethyl-2-vinyltetrahydropyran
CID 522514
1-Oxaspiro[4.5]deca-3,6-diene, 2,7-dimethyl-10-(1-methylethyl)-
CID 20268659
3,6-Diethenyltetrahydro-2-methyl-2H-pyran
CID 4417734
1-Ethoxy-p-menth-2-ene
CID 92004572
6-Ethenyl-2,2-dimethyloxane
CID 13547826
2-Ethenyl-2-methyl-5-(propan-2-yl)oxolane
CID 14040251
2-Ethenyl-5-methyloxane
CID 73823609
1-Ethenyl-3,3,5-trimethyl-1-prop-2-enoxycyclohexane
CID 89213606
(2R,6S)-2-[(E)-2-cyclohexylethenyl]-2,6-dimethyloxane
CID 16726214
(2S,6S)-2-[(E)-2-cyclohexylethenyl]-2,6-dimethyloxane
CID 16726276
2-Dimethyl-3,6-divinyltetrahydropyran
CID 129736181
Dehydroxylinalool oxide A
CID 6430803

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-2,2,3-trimethyloxane?
The IUPAC name of 6-ethenyl-2,2,3-trimethyloxane (CID 69493428) is 6-ethenyl-2,2,3-trimethyloxane.
What is the SMILES notation for 6-ethenyl-2,2,3-trimethyloxane?
The canonical SMILES for 6-ethenyl-2,2,3-trimethyloxane is C=CC1CCC(C)C(C)(C)O1.
What is the InChIKey of 6-ethenyl-2,2,3-trimethyloxane?
The InChIKey is FTXYUQUQKVCREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-5-9-7-6-8(2)10(3,4)11-9/h5,8-9H,1,6-7H2,2-4H3.
What are the key properties of 6-ethenyl-2,2,3-trimethyloxane?
6-ethenyl-2,2,3-trimethyloxane has a molecular weight of 154.25 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-2,2,3-trimethyloxane is sourced from PubChem (CID 69493428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).