7-methyl-2-trimethylsilyloct-1-en-3-ol

C12H26OSi — CID 135049603

IUPAC7-methyl-2-trimethylsilyloct-1-en-3-ol
SMILESC=C(C(O)CCCC(C)C)[Si](C)(C)C
InChIInChI=1S/C12H26OSi/c1-10(2)8-7-9-12(13)11(3)14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3
InChIKeyVWCPZSYIDZIUFE-UHFFFAOYSA-N
MW214.42 g/mol
LogP3.61
Rot. Bonds6

About 7-methyl-2-trimethylsilyloct-1-en-3-ol

7-methyl-2-trimethylsilyloct-1-en-3-ol (PubChem CID 135049603) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is 7-methyl-2-trimethylsilyloct-1-en-3-ol.

Molecular Properties

Compound Name7-methyl-2-trimethylsilyloct-1-en-3-ol
PubChem CID135049603
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name7-methyl-2-trimethylsilyloct-1-en-3-ol
SMILESC=C(C(O)CCCC(C)C)[Si](C)(C)C
InChIInChI=1S/C12H26OSi/c1-10(2)8-7-9-12(13)11(3)14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3
InChIKeyVWCPZSYIDZIUFE-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-trimethylsilyloct-1-en-3-ol?
The IUPAC name of 7-methyl-2-trimethylsilyloct-1-en-3-ol (CID 135049603) is 7-methyl-2-trimethylsilyloct-1-en-3-ol.
What is the SMILES notation for 7-methyl-2-trimethylsilyloct-1-en-3-ol?
The canonical SMILES for 7-methyl-2-trimethylsilyloct-1-en-3-ol is C=C(C(O)CCCC(C)C)[Si](C)(C)C.
What is the InChIKey of 7-methyl-2-trimethylsilyloct-1-en-3-ol?
The InChIKey is VWCPZSYIDZIUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-10(2)8-7-9-12(13)11(3)14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3.
What are the key properties of 7-methyl-2-trimethylsilyloct-1-en-3-ol?
7-methyl-2-trimethylsilyloct-1-en-3-ol has a molecular weight of 214.42 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-trimethylsilyloct-1-en-3-ol is sourced from PubChem (CID 135049603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).