tert-butyl-hept-1-en-4-yloxy-dimethylsilane

C13H28OSi — CID 73407380

IUPACtert-butyl-hept-1-en-4-yloxy-dimethylsilane
SMILESC=CCC(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28OSi/c1-8-10-12(11-9-2)14-15(6,7)13(3,4)5/h8,12H,1,9-11H2,2-7H3
InChIKeyBPQNBWWXUBHUOA-UHFFFAOYSA-N
MW228.45 g/mol
LogP4.75
Rot. Bonds6

About tert-butyl-hept-1-en-4-yloxy-dimethylsilane

tert-butyl-hept-1-en-4-yloxy-dimethylsilane (PubChem CID 73407380) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is tert-butyl-hept-1-en-4-yloxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-hept-1-en-4-yloxy-dimethylsilane
PubChem CID73407380
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Nametert-butyl-hept-1-en-4-yloxy-dimethylsilane
SMILESC=CCC(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28OSi/c1-8-10-12(11-9-2)14-15(6,7)13(3,4)5/h8,12H,1,9-11H2,2-7H3
InChIKeyBPQNBWWXUBHUOA-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 54.75
H-Bond Donors ≤ 50
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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Related Compounds

Silane, (1,1-dimethylethyl)[(1-ethenylhexyl)oxy]dimethyl-
CID 9986037
4-(Tert-butyldimethylsiloxy)-1,6-heptadiene
CID 10933202
Silane, (1,1-dimethylethyl)dimethyl(4-pentenyloxy)-
CID 10987285
4-Penten-2-ol, tert-butyldimethylsilyl ether
CID 11085022
Tert-butyl-hex-5-enyloxy-dimethyl-silane
CID 11085343
1,5-Hexadien-3-ol, tert-butyldimethylsilyl ether
CID 15653177
Silane, (1,1-dimethylethyl)(1-ethenylbutoxy)dimethyl-
CID 11206678
Tert-butyl-hex-5-en-3-yloxy-dimethylsilane
CID 15358394
Trimethyl[(pent-4-en-2-yl)oxy]silane
CID 13674372
trimethyl-[(Z)-4-trimethylsilyloxypent-1-enyl]silane
CID 134880528
Hex-1-en-3-yloxy(trimethyl)silane
CID 262863
4-Trimethylsilyloxy-1,6-heptadiene
CID 10867024

Frequently Asked Questions

What is the IUPAC name of tert-butyl-hept-1-en-4-yloxy-dimethylsilane?
The IUPAC name of tert-butyl-hept-1-en-4-yloxy-dimethylsilane (CID 73407380) is tert-butyl-hept-1-en-4-yloxy-dimethylsilane.
What is the SMILES notation for tert-butyl-hept-1-en-4-yloxy-dimethylsilane?
The canonical SMILES for tert-butyl-hept-1-en-4-yloxy-dimethylsilane is C=CCC(CCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-hept-1-en-4-yloxy-dimethylsilane?
The InChIKey is BPQNBWWXUBHUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-8-10-12(11-9-2)14-15(6,7)13(3,4)5/h8,12H,1,9-11H2,2-7H3.
What are the key properties of tert-butyl-hept-1-en-4-yloxy-dimethylsilane?
tert-butyl-hept-1-en-4-yloxy-dimethylsilane has a molecular weight of 228.45 g/mol, XLogP of 4.75, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-hept-1-en-4-yloxy-dimethylsilane is sourced from PubChem (CID 73407380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).