(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol

C20H40O2Si — CID 11416545

IUPAC(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol
SMILESC/C=C(C)/C=C(\C)[C@@H](O[Si](CC)(CC)CC)[C@@H](C)C(O)CCC
InChIInChI=1S/C20H40O2Si/c1-9-14-19(21)18(8)20(17(7)15-16(6)10-2)22-23(11-3,12-4)13-5/h10,15,18-21H,9,11-14H2,1-8H3/b16-10+,17-15+/t18-,19?,20+/m0/s1
InChIKeyPDSXQSMYJKOSKE-CLLRNREQSA-N
MW340.62 g/mol
LogP6.09
Rot. Bonds11

About (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol

(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol (PubChem CID 11416545) has the molecular formula C20H40O2Si and a molecular weight of 340.62 g/mol. Its IUPAC name is (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol.

Molecular Properties

Compound Name(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol
PubChem CID11416545
Molecular FormulaC20H40O2Si
Molecular Weight340.62 g/mol
Exact Mass340.28
IUPAC Name(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol
SMILESC/C=C(C)/C=C(\C)[C@@H](O[Si](CC)(CC)CC)[C@@H](C)C(O)CCC
InChIInChI=1S/C20H40O2Si/c1-9-14-19(21)18(8)20(17(7)15-16(6)10-2)22-23(11-3,12-4)13-5/h10,15,18-21H,9,11-14H2,1-8H3/b16-10+,17-15+/t18-,19?,20+/m0/s1
InChIKeyPDSXQSMYJKOSKE-CLLRNREQSA-N
XLogP6.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.62
LogP ≤ 56.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-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 (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol?
The IUPAC name of (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol (CID 11416545) is (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol.
What is the SMILES notation for (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol?
The canonical SMILES for (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol is C/C=C(C)/C=C(\C)[C@@H](O[Si](CC)(CC)CC)[C@@H](C)C(O)CCC.
What is the InChIKey of (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol?
The InChIKey is PDSXQSMYJKOSKE-CLLRNREQSA-N. The full InChI is InChI=1S/C20H40O2Si/c1-9-14-19(21)18(8)20(17(7)15-16(6)10-2)22-23(11-3,12-4)13-5/h10,15,18-21H,9,11-14H2,1-8H3/b16-10+,17-15+/t18-,19?,20+/m0/s1.
What are the key properties of (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol?
(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol has a molecular weight of 340.62 g/mol, XLogP of 6.09, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol is sourced from PubChem (CID 11416545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).