(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane

C7H12O2 — CID 6950263

IUPAC(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane
SMILESC=C[C@@H]1COC(C)(C)O1
InChIInChI=1S/C7H12O2/c1-4-6-5-8-7(2,3)9-6/h4,6H,1,5H2,2-3H3/t6-/m1/s1
InChIKeySQXNZBLNWGWIHZ-ZCFIWIBFSA-N
MW128.17 g/mol
LogP1.32
Rot. Bonds1

About (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane

(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane (PubChem CID 6950263) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane.

Molecular Properties

Compound Name(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane
PubChem CID6950263
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane
SMILESC=C[C@@H]1COC(C)(C)O1
InChIInChI=1S/C7H12O2/c1-4-6-5-8-7(2,3)9-6/h4,6H,1,5H2,2-3H3/t6-/m1/s1
InChIKeySQXNZBLNWGWIHZ-ZCFIWIBFSA-N
XLogP1.32
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-Dioxolan-2-one, 4-ethenyl-
CID 2735038
2-Ethenyl-4-methyl-1,3-dioxolane
CID 17025
1,3-Dioxolane, 2-ethenyl-2-methyl-
CID 287948
2-Ethenyl-2-ethyl-1,3-dioxolane
CID 13230701
4-[(Allyloxy)methyl]-2,2-dimethyl-1,3-dioxolane
CID 2780154
(S)-4-Ethenyl-1,3-dioxolan-2-one
CID 6951171
(4R)-4-ethenyl-1,3-dioxolan-2-one
CID 2735039
1,3-Dioxolane, 4-(2,2-dibromoethenyl)-2,2-dimethyl-, (4S)-
CID 11129868
Wkbhyhnngzhwgb-uhfffaoysa-
CID 14504355
(4S)-4-ethenyl-2,2-dimethyl-1,3-dioxolane
CID 6950264
(4S)-2,2-dimethyl-4-(prop-2-enoxymethyl)-1,3-dioxolane
CID 7003814
4,5-Divinyl-1,3-dioxolan-2-one
CID 11651165

Frequently Asked Questions

What is the IUPAC name of (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane?
The IUPAC name of (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane (CID 6950263) is (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane.
What is the SMILES notation for (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane?
The canonical SMILES for (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane is C=C[C@@H]1COC(C)(C)O1.
What is the InChIKey of (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane?
The InChIKey is SQXNZBLNWGWIHZ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H12O2/c1-4-6-5-8-7(2,3)9-6/h4,6H,1,5H2,2-3H3/t6-/m1/s1.
What are the key properties of (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane?
(4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane has a molecular weight of 128.17 g/mol, XLogP of 1.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-ethenyl-2,2-dimethyl-1,3-dioxolane is sourced from PubChem (CID 6950263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).