tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane

C14H24Si — CID 10900157

IUPACtert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane
SMILESC#CCCCC=C=C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H24Si/c1-7-8-9-10-11-12-13-15(5,6)14(2,3)4/h1,11,13H,8-10H2,2-6H3
InChIKeySINANVAYOVHHQP-UHFFFAOYSA-N
MW220.43 g/mol
LogP4.55
Rot. Bonds4

About tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane

tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane (PubChem CID 10900157) has the molecular formula C14H24Si and a molecular weight of 220.43 g/mol. Its IUPAC name is tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane
PubChem CID10900157
Molecular FormulaC14H24Si
Molecular Weight220.43 g/mol
Exact Mass220.16
IUPAC Nametert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane
SMILESC#CCCCC=C=C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H24Si/c1-7-8-9-10-11-12-13-15(5,6)14(2,3)4/h1,11,13H,8-10H2,2-6H3
InChIKeySINANVAYOVHHQP-UHFFFAOYSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.43
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Triethyl(hept-6-en-1-yn-1-yl)silane
CID 112756414
Hept-6-en-1-ynyl(trimethyl)silane
CID 10678786
Trimethyl(octa-6,7-dien-1-ynyl)silane
CID 10932018
Dodeca-5,6-dien-1-ynyl(trimethyl)silane
CID 11075369
Trimethyl(octa-3,4-dien-1-ynyl)silane
CID 13028939
Trimethyl(1-trimethylsilylhept-1-en-6-ynyl)silane
CID 10889991
Trimethyl(octa-1,2-dien-7-ynyl)silane
CID 10899247
Trimethyl(8-trimethylsilylocta-1,2-dien-7-ynyl)silane
CID 11010398
Trimethyl(7-methylocta-5,6-dien-1-ynyl)silane
CID 11030650
Tert-butyl-dimethyl-(8-trimethylsilylocta-1,2-dien-7-ynyl)silane
CID 11033675
Trimethyl(7-trimethylsilylhepta-1,2-dien-6-ynyl)silane
CID 11075440
[(Z)-hept-1-en-6-ynyl]-trimethylsilane
CID 11116430

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane?
The IUPAC name of tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane (CID 10900157) is tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane.
What is the SMILES notation for tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane?
The canonical SMILES for tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane is C#CCCCC=C=C[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane?
The InChIKey is SINANVAYOVHHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24Si/c1-7-8-9-10-11-12-13-15(5,6)14(2,3)4/h1,11,13H,8-10H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane?
tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane has a molecular weight of 220.43 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-octa-1,2-dien-7-ynylsilane is sourced from PubChem (CID 10900157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).