2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane

C11H16OSi — CID 100972066

IUPAC2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane
SMILES[2H]/C=C(\[2H])CO[Si](C)(C)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-4-10-12-13(2,3)11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3/i1D,4D/b4-1+
InChIKeyUZAIMYWRLZVDEJ-PDGJVJPNSA-N
MW194.35 g/mol
LogP2.30
Rot. Bonds4

About 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane

2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane (PubChem CID 100972066) has the molecular formula C11H16OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane.

Molecular Properties

Compound Name2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane
PubChem CID100972066
Molecular FormulaC11H16OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Name2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane
SMILES[2H]/C=C(\[2H])CO[Si](C)(C)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-4-10-12-13(2,3)11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3/i1D,4D/b4-1+
InChIKeyUZAIMYWRLZVDEJ-PDGJVJPNSA-N
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 52.30
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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Frequently Asked Questions

What is the IUPAC name of 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane?
The IUPAC name of 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane (CID 100972066) is 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane.
What is the SMILES notation for 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane?
The canonical SMILES for 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane is [2H]/C=C(\[2H])CO[Si](C)(C)c1ccccc1.
What is the InChIKey of 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane?
The InChIKey is UZAIMYWRLZVDEJ-PDGJVJPNSA-N. The full InChI is InChI=1S/C11H16OSi/c1-4-10-12-13(2,3)11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3/i1D,4D/b4-1+.
What are the key properties of 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane?
2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane has a molecular weight of 194.35 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dideuterioprop-2-enoxy-dimethyl-phenylsilane is sourced from PubChem (CID 100972066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).