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

C10H16O2 — CID 11073823

IUPAC(2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
SMILESC=CC[C@@]1(C)CO[C@@](C)(C=C)O1
InChIInChI=1S/C10H16O2/c1-5-7-9(3)8-11-10(4,6-2)12-9/h5-6H,1-2,7-8H2,3-4H3/t9-,10+/m0/s1
InChIKeyRVRHIVZWFMTORR-VHSXEESVSA-N
MW168.24 g/mol
LogP2.27
Rot. Bonds3

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

(2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane (PubChem CID 11073823) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane.

Molecular Properties

Compound Name(2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
PubChem CID11073823
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
SMILESC=CC[C@@]1(C)CO[C@@](C)(C=C)O1
InChIInChI=1S/C10H16O2/c1-5-7-9(3)8-11-10(4,6-2)12-9/h5-6H,1-2,7-8H2,3-4H3/t9-,10+/m0/s1
InChIKeyRVRHIVZWFMTORR-VHSXEESVSA-N
XLogP2.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The IUPAC name of (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane (CID 11073823) is (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane.
What is the SMILES notation for (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The canonical SMILES for (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane is C=CC[C@@]1(C)CO[C@@](C)(C=C)O1.
What is the InChIKey of (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The InChIKey is RVRHIVZWFMTORR-VHSXEESVSA-N. The full InChI is InChI=1S/C10H16O2/c1-5-7-9(3)8-11-10(4,6-2)12-9/h5-6H,1-2,7-8H2,3-4H3/t9-,10+/m0/s1.
What are the key properties of (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
(2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane has a molecular weight of 168.24 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane is sourced from PubChem (CID 11073823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).