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

C10H16O2 — CID 15411810

IUPAC(4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
SMILESC=CC[C@@]1(C)COC(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-RGURZIINSA-N
MW168.24 g/mol
LogP2.27
Rot. Bonds3

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

(4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane (PubChem CID 15411810) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane.

Molecular Properties

Compound Name(4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
PubChem CID15411810
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane
SMILESC=CC[C@@]1(C)COC(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-RGURZIINSA-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'}

Analyze (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The IUPAC name of (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane (CID 15411810) is (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane.
What is the SMILES notation for (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The canonical SMILES for (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane is C=CC[C@@]1(C)COC(C)(C=C)O1.
What is the InChIKey of (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
The InChIKey is RVRHIVZWFMTORR-RGURZIINSA-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 (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane?
(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 (4S)-2-ethenyl-2,4-dimethyl-4-prop-2-enyl-1,3-dioxolane is sourced from PubChem (CID 15411810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).