tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane

C10H20OSi — CID 11030608

IUPACtert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane
SMILESC#C[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H20OSi/c1-8-9(2)11-12(6,7)10(3,4)5/h1,9H,2-7H3/t9-/m1/s1
InChIKeyDYUHDPKTGYOFOJ-SECBINFHSA-N
MW184.35 g/mol
LogP3.03
Rot. Bonds2

About tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane

tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane (PubChem CID 11030608) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane
PubChem CID11030608
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Nametert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane
SMILESC#C[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H20OSi/c1-8-9(2)11-12(6,7)10(3,4)5/h1,9H,2-7H3/t9-/m1/s1
InChIKeyDYUHDPKTGYOFOJ-SECBINFHSA-N
XLogP3.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane (CID 11030608) is tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane is C#C[C@@H](C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane?
The InChIKey is DYUHDPKTGYOFOJ-SECBINFHSA-N. The full InChI is InChI=1S/C10H20OSi/c1-8-9(2)11-12(6,7)10(3,4)5/h1,9H,2-7H3/t9-/m1/s1.
What are the key properties of tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane?
tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane has a molecular weight of 184.35 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-but-3-yn-2-yl]oxy-dimethylsilane is sourced from PubChem (CID 11030608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).