(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one

C14H26O5Si — CID 11335664

IUPAC(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@@H]1C1OCCO1
InChIInChI=1S/C14H26O5Si/c1-14(2,3)20(4,5)18-9-11-10(8-12(15)19-11)13-16-6-7-17-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m0/s1
InChIKeyCFGHJWVBRVPUQR-WDEREUQCSA-N
MW302.44 g/mol
LogP2.31
Rot. Bonds4

About (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one

(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one (PubChem CID 11335664) has the molecular formula C14H26O5Si and a molecular weight of 302.44 g/mol. Its IUPAC name is (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one.

Molecular Properties

Compound Name(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one
PubChem CID11335664
Molecular FormulaC14H26O5Si
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC Name(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@@H]1C1OCCO1
InChIInChI=1S/C14H26O5Si/c1-14(2,3)20(4,5)18-9-11-10(8-12(15)19-11)13-16-6-7-17-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m0/s1
InChIKeyCFGHJWVBRVPUQR-WDEREUQCSA-N
XLogP2.31
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one 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,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one?
The IUPAC name of (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one (CID 11335664) is (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one.
What is the SMILES notation for (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one?
The canonical SMILES for (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one is CC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@@H]1C1OCCO1.
What is the InChIKey of (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one?
The InChIKey is CFGHJWVBRVPUQR-WDEREUQCSA-N. The full InChI is InChI=1S/C14H26O5Si/c1-14(2,3)20(4,5)18-9-11-10(8-12(15)19-11)13-16-6-7-17-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m0/s1.
What are the key properties of (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one?
(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one has a molecular weight of 302.44 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(1,3-dioxolan-2-yl)oxolan-2-one is sourced from PubChem (CID 11335664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).