tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane

C8H21ClNPSi — CID 13354590

IUPACtert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane
SMILESCC(C)(C)P(C)(Cl)=N[Si](C)(C)C
InChIInChI=1S/C8H21ClNPSi/c1-8(2,3)11(4,9)10-12(5,6)7/h1-7H3
InChIKeyYGOFODFQSLWRBQ-UHFFFAOYSA-N
MW225.78 g/mol
LogP4.60
Rot. Bonds1

About tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane

tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane (PubChem CID 13354590) has the molecular formula C8H21ClNPSi and a molecular weight of 225.78 g/mol. Its IUPAC name is tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane.

Molecular Properties

Compound Nametert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane
PubChem CID13354590
Molecular FormulaC8H21ClNPSi
Molecular Weight225.78 g/mol
Exact Mass225.09
IUPAC Nametert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane
SMILESCC(C)(C)P(C)(Cl)=N[Si](C)(C)C
InChIInChI=1S/C8H21ClNPSi/c1-8(2,3)11(4,9)10-12(5,6)7/h1-7H3
InChIKeyYGOFODFQSLWRBQ-UHFFFAOYSA-N
XLogP4.60
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.78
LogP ≤ 54.60
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 tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane?
The IUPAC name of tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane (CID 13354590) is tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane.
What is the SMILES notation for tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane?
The canonical SMILES for tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane is CC(C)(C)P(C)(Cl)=N[Si](C)(C)C.
What is the InChIKey of tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane?
The InChIKey is YGOFODFQSLWRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21ClNPSi/c1-8(2,3)11(4,9)10-12(5,6)7/h1-7H3.
What are the key properties of tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane?
tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane has a molecular weight of 225.78 g/mol, XLogP of 4.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-chloro-methyl-trimethylsilylimino-lambda5-phosphane is sourced from PubChem (CID 13354590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).