tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane

C16H32OSi — CID 11097563

IUPACtert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane
SMILESC#CC[C@H](C)CCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-8-12-15(2)13-10-9-11-14-17-18(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3/t15-/m0/s1
InChIKeyUXVCAEQSBMXWOL-HNNXBMFYSA-N
MW268.52 g/mol
LogP5.23
Rot. Bonds8

About tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane

tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane (PubChem CID 11097563) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane
PubChem CID11097563
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane
SMILESC#CC[C@H](C)CCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-8-12-15(2)13-10-9-11-14-17-18(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3/t15-/m0/s1
InChIKeyUXVCAEQSBMXWOL-HNNXBMFYSA-N
XLogP5.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane (CID 11097563) is tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane is C#CC[C@H](C)CCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane?
The InChIKey is UXVCAEQSBMXWOL-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-8-12-15(2)13-10-9-11-14-17-18(6,7)16(3,4)5/h1,15H,9-14H2,2-7H3/t15-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane?
tert-butyl-dimethyl-[(6R)-6-methylnon-8-ynoxy]silane has a molecular weight of 268.52 g/mol, XLogP of 5.23, 8 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-methylnon-8-ynoxy]silane is sourced from PubChem (CID 11097563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).