2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane

C9H25BrNPSi2 — CID 101211939

IUPAC2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane
SMILESCC(C)P(Br)N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C9H25BrNPSi2/c1-9(2)12(10)11(13(3,4)5)14(6,7)8/h9H,1-8H3
InChIKeyMEFRVWAXCZPJJK-UHFFFAOYSA-N
MW314.36 g/mol
LogP5.07
Rot. Bonds4

About 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane

2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane (PubChem CID 101211939) has the molecular formula C9H25BrNPSi2 and a molecular weight of 314.36 g/mol. Its IUPAC name is 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane.

Molecular Properties

Compound Name2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane
PubChem CID101211939
Molecular FormulaC9H25BrNPSi2
Molecular Weight314.36 g/mol
Exact Mass313.04
IUPAC Name2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane
SMILESCC(C)P(Br)N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C9H25BrNPSi2/c1-9(2)12(10)11(13(3,4)5)14(6,7)8/h9H,1-8H3
InChIKeyMEFRVWAXCZPJJK-UHFFFAOYSA-N
XLogP5.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.36
LogP ≤ 55.07
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 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane?
The IUPAC name of 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane (CID 101211939) is 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane.
What is the SMILES notation for 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane?
The canonical SMILES for 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane is CC(C)P(Br)N([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane?
The InChIKey is MEFRVWAXCZPJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H25BrNPSi2/c1-9(2)12(10)11(13(3,4)5)14(6,7)8/h9H,1-8H3.
What are the key properties of 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane?
2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane has a molecular weight of 314.36 g/mol, XLogP of 5.07, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[bis(trimethylsilyl)amino]-bromophosphanyl]propane is sourced from PubChem (CID 101211939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).