5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol

C14H24OSi — CID 139252754

IUPAC5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol
SMILESC=CCCCC(=C)C(O)CC#C[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-6-7-8-10-13(2)14(15)11-9-12-16(3,4)5/h6,14-15H,1-2,7-8,10-11H2,3-5H3
InChIKeyUJUDSUIUXMZMPQ-UHFFFAOYSA-N
MW236.43 g/mol
LogP3.53
Rot. Bonds6

About 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol

5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol (PubChem CID 139252754) has the molecular formula C14H24OSi and a molecular weight of 236.43 g/mol. Its IUPAC name is 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol.

Molecular Properties

Compound Name5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol
PubChem CID139252754
Molecular FormulaC14H24OSi
Molecular Weight236.43 g/mol
Exact Mass236.16
IUPAC Name5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol
SMILESC=CCCCC(=C)C(O)CC#C[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-6-7-8-10-13(2)14(15)11-9-12-16(3,4)5/h6,14-15H,1-2,7-8,10-11H2,3-5H3
InChIKeyUJUDSUIUXMZMPQ-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol?
The IUPAC name of 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol (CID 139252754) is 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol.
What is the SMILES notation for 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol?
The canonical SMILES for 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol is C=CCCCC(=C)C(O)CC#C[Si](C)(C)C.
What is the InChIKey of 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol?
The InChIKey is UJUDSUIUXMZMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24OSi/c1-6-7-8-10-13(2)14(15)11-9-12-16(3,4)5/h6,14-15H,1-2,7-8,10-11H2,3-5H3.
What are the key properties of 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol?
5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol has a molecular weight of 236.43 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol is sourced from PubChem (CID 139252754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).