[(E)-hept-4-en-1-ynyl]-trimethylsilane

C10H18Si — CID 11400987

IUPAC[(E)-hept-4-en-1-ynyl]-trimethylsilane
SMILESCC/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C10H18Si/c1-5-6-7-8-9-10-11(2,3)4/h6-7H,5,8H2,1-4H3/b7-6+
InChIKeyMROMJYZKPXFMOQ-VOTSOKGWSA-N
MW166.34 g/mol
LogP3.22
Rot. Bonds2

About [(E)-hept-4-en-1-ynyl]-trimethylsilane

[(E)-hept-4-en-1-ynyl]-trimethylsilane (PubChem CID 11400987) has the molecular formula C10H18Si and a molecular weight of 166.34 g/mol. Its IUPAC name is [(E)-hept-4-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-hept-4-en-1-ynyl]-trimethylsilane
PubChem CID11400987
Molecular FormulaC10H18Si
Molecular Weight166.34 g/mol
Exact Mass166.12
IUPAC Name[(E)-hept-4-en-1-ynyl]-trimethylsilane
SMILESCC/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C10H18Si/c1-5-6-7-8-9-10-11(2,3)4/h6-7H,5,8H2,1-4H3/b7-6+
InChIKeyMROMJYZKPXFMOQ-VOTSOKGWSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.34
LogP ≤ 53.22
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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Related Compounds

Silane, trimethyl(1-methyl-1-butenyl)-, (E)-
CID 5366563
1-Trimethylsilylpent-1-en-4-yne
CID 579356
Silane, trimethyl-3-penten-2-yl-, trans
CID 5366362
Silane, trimethyl-2-pentenyl-, (E)-
CID 5366396
(2E)-2-Hexenyl(trimethyl)silane
CID 5366398
Silane, trimethyl-2,6-octadienyl-
CID 5366375
Silane, triethyl-2-pentenyl-, (Z)-
CID 5370496
[(4E)-5,9-dimethyldeca-4,8-dien-1-ynyl]-trimethylsilane
CID 10354026
(E)-1-(Trimethylsilyl)-3-hepten-1-yne
CID 10559007
trimethyl-[(E)-oct-3-en-1-ynyl]silane
CID 13679641
trimethyl-[(E)-4-methylhex-3-en-1-ynyl]silane
CID 134901516
Trimethyl[(2E)-1-methyl-2-butenyl]silane
CID 552124

Frequently Asked Questions

What is the IUPAC name of [(E)-hept-4-en-1-ynyl]-trimethylsilane?
The IUPAC name of [(E)-hept-4-en-1-ynyl]-trimethylsilane (CID 11400987) is [(E)-hept-4-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(E)-hept-4-en-1-ynyl]-trimethylsilane?
The canonical SMILES for [(E)-hept-4-en-1-ynyl]-trimethylsilane is CC/C=C/CC#C[Si](C)(C)C.
What is the InChIKey of [(E)-hept-4-en-1-ynyl]-trimethylsilane?
The InChIKey is MROMJYZKPXFMOQ-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H18Si/c1-5-6-7-8-9-10-11(2,3)4/h6-7H,5,8H2,1-4H3/b7-6+.
What are the key properties of [(E)-hept-4-en-1-ynyl]-trimethylsilane?
[(E)-hept-4-en-1-ynyl]-trimethylsilane has a molecular weight of 166.34 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-hept-4-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 11400987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).