tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane

C19H32OSi — CID 102486594

IUPACtert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane
SMILESC=C=C(CC[C@H](CC#CC)C(=C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H32OSi/c1-10-12-13-17(16(3)4)14-15-18(11-2)20-21(8,9)19(5,6)7/h17H,2-3,13-15H2,1,4-9H3/t17-/m0/s1
InChIKeyUPQCIOPNKWGIAW-KRWDZBQOSA-N
MW304.55 g/mol
LogP6.06
Rot. Bonds7

About tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane

tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane (PubChem CID 102486594) has the molecular formula C19H32OSi and a molecular weight of 304.55 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane
PubChem CID102486594
Molecular FormulaC19H32OSi
Molecular Weight304.55 g/mol
Exact Mass304.22
IUPAC Nametert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane
SMILESC=C=C(CC[C@H](CC#CC)C(=C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H32OSi/c1-10-12-13-17(16(3)4)14-15-18(11-2)20-21(8,9)19(5,6)7/h17H,2-3,13-15H2,1,4-9H3/t17-/m0/s1
InChIKeyUPQCIOPNKWGIAW-KRWDZBQOSA-N
XLogP6.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.55
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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 tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane (CID 102486594) is tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane is C=C=C(CC[C@H](CC#CC)C(=C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane?
The InChIKey is UPQCIOPNKWGIAW-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H32OSi/c1-10-12-13-17(16(3)4)14-15-18(11-2)20-21(8,9)19(5,6)7/h17H,2-3,13-15H2,1,4-9H3/t17-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane?
tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane has a molecular weight of 304.55 g/mol, XLogP of 6.06, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane is sourced from PubChem (CID 102486594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).