2-(trimethylsilylmethyl)hept-1-en-4-ol

C11H24OSi — CID 10726730

IUPAC2-(trimethylsilylmethyl)hept-1-en-4-ol
SMILESC=C(CC(O)CCC)C[Si](C)(C)C
InChIInChI=1S/C11H24OSi/c1-6-7-11(12)8-10(2)9-13(3,4)5/h11-12H,2,6-9H2,1,3-5H3
InChIKeyPXDRYXMXVYLHFJ-UHFFFAOYSA-N
MW200.40 g/mol
LogP3.43
Rot. Bonds6

About 2-(trimethylsilylmethyl)hept-1-en-4-ol

2-(trimethylsilylmethyl)hept-1-en-4-ol (PubChem CID 10726730) has the molecular formula C11H24OSi and a molecular weight of 200.40 g/mol. Its IUPAC name is 2-(trimethylsilylmethyl)hept-1-en-4-ol.

Molecular Properties

Compound Name2-(trimethylsilylmethyl)hept-1-en-4-ol
PubChem CID10726730
Molecular FormulaC11H24OSi
Molecular Weight200.40 g/mol
Exact Mass200.16
IUPAC Name2-(trimethylsilylmethyl)hept-1-en-4-ol
SMILESC=C(CC(O)CCC)C[Si](C)(C)C
InChIInChI=1S/C11H24OSi/c1-6-7-11(12)8-10(2)9-13(3,4)5/h11-12H,2,6-9H2,1,3-5H3
InChIKeyPXDRYXMXVYLHFJ-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.40
LogP ≤ 53.43
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 2-(trimethylsilylmethyl)hept-1-en-4-ol?
The IUPAC name of 2-(trimethylsilylmethyl)hept-1-en-4-ol (CID 10726730) is 2-(trimethylsilylmethyl)hept-1-en-4-ol.
What is the SMILES notation for 2-(trimethylsilylmethyl)hept-1-en-4-ol?
The canonical SMILES for 2-(trimethylsilylmethyl)hept-1-en-4-ol is C=C(CC(O)CCC)C[Si](C)(C)C.
What is the InChIKey of 2-(trimethylsilylmethyl)hept-1-en-4-ol?
The InChIKey is PXDRYXMXVYLHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OSi/c1-6-7-11(12)8-10(2)9-13(3,4)5/h11-12H,2,6-9H2,1,3-5H3.
What are the key properties of 2-(trimethylsilylmethyl)hept-1-en-4-ol?
2-(trimethylsilylmethyl)hept-1-en-4-ol has a molecular weight of 200.40 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trimethylsilylmethyl)hept-1-en-4-ol is sourced from PubChem (CID 10726730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).