8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol

C14H26O4Si — CID 135042829

IUPAC8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol
SMILESCC(C)(C)[Si](C)(C)OC1=CCC2(CC1O)OCCO2
InChIInChI=1S/C14H26O4Si/c1-13(2,3)19(4,5)18-12-6-7-14(10-11(12)15)16-8-9-17-14/h6,11,15H,7-10H2,1-5H3
InChIKeyIQZLOCWWOGAYTJ-UHFFFAOYSA-N
MW286.44 g/mol
LogP2.79
Rot. Bonds2

About 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol

8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol (PubChem CID 135042829) has the molecular formula C14H26O4Si and a molecular weight of 286.44 g/mol. Its IUPAC name is 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol.

Molecular Properties

Compound Name8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol
PubChem CID135042829
Molecular FormulaC14H26O4Si
Molecular Weight286.44 g/mol
Exact Mass286.16
IUPAC Name8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol
SMILESCC(C)(C)[Si](C)(C)OC1=CCC2(CC1O)OCCO2
InChIInChI=1S/C14H26O4Si/c1-13(2,3)19(4,5)18-12-6-7-14(10-11(12)15)16-8-9-17-14/h6,11,15H,7-10H2,1-5H3
InChIKeyIQZLOCWWOGAYTJ-UHFFFAOYSA-N
XLogP2.79
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.44
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-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 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol?
The IUPAC name of 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol (CID 135042829) is 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol.
What is the SMILES notation for 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol?
The canonical SMILES for 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol is CC(C)(C)[Si](C)(C)OC1=CCC2(CC1O)OCCO2.
What is the InChIKey of 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol?
The InChIKey is IQZLOCWWOGAYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O4Si/c1-13(2,3)19(4,5)18-12-6-7-14(10-11(12)15)16-8-9-17-14/h6,11,15H,7-10H2,1-5H3.
What are the key properties of 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol?
8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol has a molecular weight of 286.44 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[tert-butyl(dimethyl)silyl]oxy-1,4-dioxaspiro[4.5]dec-8-en-7-ol is sourced from PubChem (CID 135042829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).