7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol

C16H34O2Si — CID 134857930

IUPAC7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol
SMILESC=C(CCO[Si](C)(C)C(C)(C)C)CC(O)(CC)CC
InChIInChI=1S/C16H34O2Si/c1-9-16(17,10-2)13-14(3)11-12-18-19(7,8)15(4,5)6/h17H,3,9-13H2,1-2,4-8H3
InChIKeyFQWQMVIPDOZLBS-UHFFFAOYSA-N
MW286.53 g/mol
LogP4.90
Rot. Bonds8

About 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol

7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol (PubChem CID 134857930) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol.

Molecular Properties

Compound Name7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol
PubChem CID134857930
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol
SMILESC=C(CCO[Si](C)(C)C(C)(C)C)CC(O)(CC)CC
InChIInChI=1S/C16H34O2Si/c1-9-16(17,10-2)13-14(3)11-12-18-19(7,8)15(4,5)6/h17H,3,9-13H2,1-2,4-8H3
InChIKeyFQWQMVIPDOZLBS-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.53
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-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 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol?
The IUPAC name of 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol (CID 134857930) is 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol.
What is the SMILES notation for 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol?
The canonical SMILES for 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol is C=C(CCO[Si](C)(C)C(C)(C)C)CC(O)(CC)CC.
What is the InChIKey of 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol?
The InChIKey is FQWQMVIPDOZLBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-9-16(17,10-2)13-14(3)11-12-18-19(7,8)15(4,5)6/h17H,3,9-13H2,1-2,4-8H3.
What are the key properties of 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol?
7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol has a molecular weight of 286.53 g/mol, XLogP of 4.90, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-5-methylideneheptan-3-ol is sourced from PubChem (CID 134857930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).