ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane

C12H30NPSi — CID 12538831

IUPACditert-butyl-methyl-trimethylsilylimino-λ5-phosphane
SMILESCC(C)(C)P(C)(=N[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C12H30NPSi/c1-11(2,3)14(7,12(4,5)6)13-15(8,9)10/h1-10H3
InChIKeyGNVOKRWFZUYOPX-UHFFFAOYSA-N
MW247.44 g/mol
LogP5.25
Rot. Bonds1

About ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane

ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane (PubChem CID 12538831) has the molecular formula C12H30NPSi and a molecular weight of 247.44 g/mol. Its IUPAC name is ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane.

Molecular Properties

Compound Nameditert-butyl-methyl-trimethylsilylimino-λ5-phosphane
PubChem CID12538831
Molecular FormulaC12H30NPSi
Molecular Weight247.44 g/mol
Exact Mass247.19
IUPAC Nameditert-butyl-methyl-trimethylsilylimino-λ5-phosphane
SMILESCC(C)(C)P(C)(=N[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C12H30NPSi/c1-11(2,3)14(7,12(4,5)6)13-15(8,9)10/h1-10H3
InChIKeyGNVOKRWFZUYOPX-UHFFFAOYSA-N
XLogP5.25
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500247.44
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane?
The IUPAC name of ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane (CID 12538831) is ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane.
What is the SMILES notation for ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane?
The canonical SMILES for ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane is CC(C)(C)P(C)(=N[Si](C)(C)C)C(C)(C)C.
What is the InChIKey of ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane?
The InChIKey is GNVOKRWFZUYOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30NPSi/c1-11(2,3)14(7,12(4,5)6)13-15(8,9)10/h1-10H3.
What are the key properties of ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane?
ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane has a molecular weight of 247.44 g/mol, XLogP of 5.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ditert-butyl-methyl-trimethylsilylimino-λ5-phosphane is sourced from PubChem (CID 12538831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).