tris(trimethylsilyloxy)phosphaniumylboranuide

C9H30BO3PSi3 — CID 161255283

IUPACtris(trimethylsilyloxy)phosphaniumylboranuide
SMILES[BH3-][P+](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C9H30BO3PSi3/c1-15(2,3)11-14(10,12-16(4,5)6)13-17(7,8)9/h1-10H3
InChIKeyKBOPPXVBERMQNU-UHFFFAOYSA-N
MW312.38 g/mol
LogP3.58
Rot. Bonds6

About tris(trimethylsilyloxy)phosphaniumylboranuide

tris(trimethylsilyloxy)phosphaniumylboranuide (PubChem CID 161255283) has the molecular formula C9H30BO3PSi3 and a molecular weight of 312.38 g/mol. Its IUPAC name is tris(trimethylsilyloxy)phosphaniumylboranuide.

Molecular Properties

Compound Nametris(trimethylsilyloxy)phosphaniumylboranuide
PubChem CID161255283
Molecular FormulaC9H30BO3PSi3
Molecular Weight312.38 g/mol
Exact Mass312.13
IUPAC Nametris(trimethylsilyloxy)phosphaniumylboranuide
SMILES[BH3-][P+](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C9H30BO3PSi3/c1-15(2,3)11-14(10,12-16(4,5)6)13-17(7,8)9/h1-10H3
InChIKeyKBOPPXVBERMQNU-UHFFFAOYSA-N
XLogP3.58
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tris(trimethylsilyloxy)phosphaniumylboranuide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tris(trimethylsilyloxy)phosphaniumylboranuide?
The IUPAC name of tris(trimethylsilyloxy)phosphaniumylboranuide (CID 161255283) is tris(trimethylsilyloxy)phosphaniumylboranuide.
What is the SMILES notation for tris(trimethylsilyloxy)phosphaniumylboranuide?
The canonical SMILES for tris(trimethylsilyloxy)phosphaniumylboranuide is [BH3-][P+](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of tris(trimethylsilyloxy)phosphaniumylboranuide?
The InChIKey is KBOPPXVBERMQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H30BO3PSi3/c1-15(2,3)11-14(10,12-16(4,5)6)13-17(7,8)9/h1-10H3.
What are the key properties of tris(trimethylsilyloxy)phosphaniumylboranuide?
tris(trimethylsilyloxy)phosphaniumylboranuide has a molecular weight of 312.38 g/mol, XLogP of 3.58, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(trimethylsilyloxy)phosphaniumylboranuide is sourced from PubChem (CID 161255283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).