[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane

C14H24Si — CID 10376191

IUPAC[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane
SMILESC=CC/C=C(\C#C[Si](C)(C)C)CCCC
InChIInChI=1S/C14H24Si/c1-6-8-10-14(11-9-7-2)12-13-15(3,4)5/h6,10H,1,7-9,11H2,2-5H3/b14-10-
InChIKeyRCJDGRJKWJUOTG-UVTDQMKNSA-N
MW220.43 g/mol
LogP4.56
Rot. Bonds5

About [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane

[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane (PubChem CID 10376191) has the molecular formula C14H24Si and a molecular weight of 220.43 g/mol. Its IUPAC name is [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane
PubChem CID10376191
Molecular FormulaC14H24Si
Molecular Weight220.43 g/mol
Exact Mass220.16
IUPAC Name[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane
SMILESC=CC/C=C(\C#C[Si](C)(C)C)CCCC
InChIInChI=1S/C14H24Si/c1-6-8-10-14(11-9-7-2)12-13-15(3,4)5/h6,10H,1,7-9,11H2,2-5H3/b14-10-
InChIKeyRCJDGRJKWJUOTG-UVTDQMKNSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.43
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane?
The IUPAC name of [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane (CID 10376191) is [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane?
The canonical SMILES for [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane is C=CC/C=C(\C#C[Si](C)(C)C)CCCC.
What is the InChIKey of [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane?
The InChIKey is RCJDGRJKWJUOTG-UVTDQMKNSA-N. The full InChI is InChI=1S/C14H24Si/c1-6-8-10-14(11-9-7-2)12-13-15(3,4)5/h6,10H,1,7-9,11H2,2-5H3/b14-10-.
What are the key properties of [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane?
[(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane has a molecular weight of 220.43 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3Z)-3-butylhepta-3,6-dien-1-ynyl]-trimethylsilane is sourced from PubChem (CID 10376191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).