(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol

C13H28OSi — CID 10331380

IUPAC(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol
SMILESC[C@H](C/C=C\C[Si](C)(C)C)C[C@@H](C)CO
InChIInChI=1S/C13H28OSi/c1-12(10-13(2)11-14)8-6-7-9-15(3,4)5/h6-7,12-14H,8-11H2,1-5H3/b7-6-/t12-,13-/m1/s1
InChIKeyNCYWOWOQBMTBTJ-ZSBJFDRYSA-N
MW228.45 g/mol
LogP3.93
Rot. Bonds7

About (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol

(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol (PubChem CID 10331380) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol.

Molecular Properties

Compound Name(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol
PubChem CID10331380
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Name(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol
SMILESC[C@H](C/C=C\C[Si](C)(C)C)C[C@@H](C)CO
InChIInChI=1S/C13H28OSi/c1-12(10-13(2)11-14)8-6-7-9-15(3,4)5/h6-7,12-14H,8-11H2,1-5H3/b7-6-/t12-,13-/m1/s1
InChIKeyNCYWOWOQBMTBTJ-ZSBJFDRYSA-N
XLogP3.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol?
The IUPAC name of (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol (CID 10331380) is (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol.
What is the SMILES notation for (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol?
The canonical SMILES for (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol is C[C@H](C/C=C\C[Si](C)(C)C)C[C@@H](C)CO.
What is the InChIKey of (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol?
The InChIKey is NCYWOWOQBMTBTJ-ZSBJFDRYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-12(10-13(2)11-14)8-6-7-9-15(3,4)5/h6-7,12-14H,8-11H2,1-5H3/b7-6-/t12-,13-/m1/s1.
What are the key properties of (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol?
(Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol has a molecular weight of 228.45 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2R,4R)-2,4-dimethyl-8-trimethylsilyloct-6-en-1-ol is sourced from PubChem (CID 10331380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).