(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol

C18H36O2Si — CID 171749294

IUPAC(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol
SMILESC=CC(C/C=C/CCCO[Si](C)(C)C(C)(C)C)CCCO
InChIInChI=1S/C18H36O2Si/c1-7-17(14-12-15-19)13-10-8-9-11-16-20-21(5,6)18(2,3)4/h7-8,10,17,19H,1,9,11-16H2,2-6H3/b10-8+
InChIKeyVXXKEHVZPUNTPY-CSKARUKUSA-N
MW312.57 g/mol
LogP5.31
Rot. Bonds11

About (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol

(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol (PubChem CID 171749294) has the molecular formula C18H36O2Si and a molecular weight of 312.57 g/mol. Its IUPAC name is (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol.

Molecular Properties

Compound Name(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol
PubChem CID171749294
Molecular FormulaC18H36O2Si
Molecular Weight312.57 g/mol
Exact Mass312.25
IUPAC Name(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol
SMILESC=CC(C/C=C/CCCO[Si](C)(C)C(C)(C)C)CCCO
InChIInChI=1S/C18H36O2Si/c1-7-17(14-12-15-19)13-10-8-9-11-16-20-21(5,6)18(2,3)4/h7-8,10,17,19H,1,9,11-16H2,2-6H3/b10-8+
InChIKeyVXXKEHVZPUNTPY-CSKARUKUSA-N
XLogP5.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.57
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-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 (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol?
The IUPAC name of (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol (CID 171749294) is (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol.
What is the SMILES notation for (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol?
The canonical SMILES for (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol is C=CC(C/C=C/CCCO[Si](C)(C)C(C)(C)C)CCCO.
What is the InChIKey of (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol?
The InChIKey is VXXKEHVZPUNTPY-CSKARUKUSA-N. The full InChI is InChI=1S/C18H36O2Si/c1-7-17(14-12-15-19)13-10-8-9-11-16-20-21(5,6)18(2,3)4/h7-8,10,17,19H,1,9,11-16H2,2-6H3/b10-8+.
What are the key properties of (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol?
(E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol has a molecular weight of 312.57 g/mol, XLogP of 5.31, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-10-[tert-butyl(dimethyl)silyl]oxy-4-ethenyldec-6-en-1-ol is sourced from PubChem (CID 171749294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).