tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane

C10H18OSi — CID 11298336

IUPACtert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane
SMILESCC(C)(C)[Si](C)(C)C#C[C@H]1CO1
InChIInChI=1S/C10H18OSi/c1-10(2,3)12(4,5)7-6-9-8-11-9/h9H,8H2,1-5H3/t9-/m0/s1
InChIKeyWNHJBSMQHFZYHO-VIFPVBQESA-N
MW182.34 g/mol
LogP2.44
Rot. Bonds

About tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane

tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane (PubChem CID 11298336) has the molecular formula C10H18OSi and a molecular weight of 182.34 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane
PubChem CID11298336
Molecular FormulaC10H18OSi
Molecular Weight182.34 g/mol
Exact Mass182.11
IUPAC Nametert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane
SMILESCC(C)(C)[Si](C)(C)C#C[C@H]1CO1
InChIInChI=1S/C10H18OSi/c1-10(2,3)12(4,5)7-6-9-8-11-9/h9H,8H2,1-5H3/t9-/m0/s1
InChIKeyWNHJBSMQHFZYHO-VIFPVBQESA-N
XLogP2.44
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.34
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Trimethyl[2-(2-methyloxiran-2-yl)ethynyl]silane
CID 155943392
Qhzcgdyeudelql-uwvggrqhsa-
CID 11321826
Trimethyl-[2-(oxiran-2-yl)ethynyl]silane
CID 45079317
trimethyl-[3-[(2S)-oxiran-2-yl]prop-1-ynyl]silane
CID 11116278
trimethyl-[3-[(2R)-oxiran-2-yl]prop-1-ynyl]silane
CID 11332584
4-Ethoxypent-1-ynyl(trimethyl)silane
CID 135023128
tert-butyl-dimethyl-[2-[(2R,3S)-3-methyloxiran-2-yl]ethynyl]silane
CID 15739461
Trimethyl-[4-(oxiran-2-yl)but-2-ynyl]silane
CID 10374829
tert-butyl-dimethyl-[2-[(2R)-oxiran-2-yl]ethynyl]silane
CID 10899305
Tert-butyl-(4-ethoxybut-3-yn-2-yloxy)-dimethylsilane
CID 13461138
Trimethyl(3-(oxiran-2-yl)prop-1-yn-1-yl)silane
CID 15236697
Oxiran-2-ylmethyl-tri(propan-2-yl)silane
CID 15369424

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane?
The IUPAC name of tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane (CID 11298336) is tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane is CC(C)(C)[Si](C)(C)C#C[C@H]1CO1.
What is the InChIKey of tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane?
The InChIKey is WNHJBSMQHFZYHO-VIFPVBQESA-N. The full InChI is InChI=1S/C10H18OSi/c1-10(2,3)12(4,5)7-6-9-8-11-9/h9H,8H2,1-5H3/t9-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane?
tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane has a molecular weight of 182.34 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane is sourced from PubChem (CID 11298336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).