1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol

C12H24O3Si — CID 10776720

IUPAC1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol
SMILESC=C(CC(O)[C@H]1COC(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C12H24O3Si/c1-9(16(4,5)6)7-10(13)11-8-14-12(2,3)15-11/h10-11,13H,1,7-8H2,2-6H3/t10?,11-/m1/s1
InChIKeyKCIABBQYTSGMOF-RRKGBCIJSA-N
MW244.41 g/mol
LogP2.32
Rot. Bonds4

About 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol

1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol (PubChem CID 10776720) has the molecular formula C12H24O3Si and a molecular weight of 244.41 g/mol. Its IUPAC name is 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol.

Molecular Properties

Compound Name1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol
PubChem CID10776720
Molecular FormulaC12H24O3Si
Molecular Weight244.41 g/mol
Exact Mass244.15
IUPAC Name1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol
SMILESC=C(CC(O)[C@H]1COC(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C12H24O3Si/c1-9(16(4,5)6)7-10(13)11-8-14-12(2,3)15-11/h10-11,13H,1,7-8H2,2-6H3/t10?,11-/m1/s1
InChIKeyKCIABBQYTSGMOF-RRKGBCIJSA-N
XLogP2.32
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.41
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol 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 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol?
The IUPAC name of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol (CID 10776720) is 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol.
What is the SMILES notation for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol?
The canonical SMILES for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol is C=C(CC(O)[C@H]1COC(C)(C)O1)[Si](C)(C)C.
What is the InChIKey of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol?
The InChIKey is KCIABBQYTSGMOF-RRKGBCIJSA-N. The full InChI is InChI=1S/C12H24O3Si/c1-9(16(4,5)6)7-10(13)11-8-14-12(2,3)15-11/h10-11,13H,1,7-8H2,2-6H3/t10?,11-/m1/s1.
What are the key properties of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol?
1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol has a molecular weight of 244.41 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol is sourced from PubChem (CID 10776720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).