4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol

C12H26OSi — CID 86691336

IUPAC4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol
SMILESC=C(C[Si](C)(C)C)C(CO)CC(C)C
InChIInChI=1S/C12H26OSi/c1-10(2)7-12(8-13)11(3)9-14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3
InChIKeyUGKVMWRKITXHOX-UHFFFAOYSA-N
MW214.42 g/mol
LogP3.54
Rot. Bonds6

About 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol

4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol (PubChem CID 86691336) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol.

Molecular Properties

Compound Name4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol
PubChem CID86691336
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol
SMILESC=C(C[Si](C)(C)C)C(CO)CC(C)C
InChIInChI=1S/C12H26OSi/c1-10(2)7-12(8-13)11(3)9-14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3
InChIKeyUGKVMWRKITXHOX-UHFFFAOYSA-N
XLogP3.54
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 ≤ 53.54
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 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol?
The IUPAC name of 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol (CID 86691336) is 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol.
What is the SMILES notation for 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol?
The canonical SMILES for 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol is C=C(C[Si](C)(C)C)C(CO)CC(C)C.
What is the InChIKey of 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol?
The InChIKey is UGKVMWRKITXHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-10(2)7-12(8-13)11(3)9-14(4,5)6/h10,12-13H,3,7-9H2,1-2,4-6H3.
What are the key properties of 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol?
4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol has a molecular weight of 214.42 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-trimethylsilylprop-1-en-2-yl)pentan-1-ol is sourced from PubChem (CID 86691336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).