trimethoxy-tris(prop-2-enyl)silylazanium bromide

C12H24BrNO3Si — CID 175251728

IUPACtrimethoxy-tris(prop-2-enyl)silylazanium bromide
SMILESC=CC[Si](CC=C)(CC=C)[N+](OC)(OC)OC.[Br-]
InChIInChI=1S/C12H24NO3Si.BrH/c1-7-10-17(11-8-2,12-9-3)13(14-4,15-5)16-6;/h7-9H,1-3,10-12H2,4-6H3;1H/q+1;/p-1
InChIKeyJLKCPRNGQUDHOC-UHFFFAOYSA-M
MW338.32 g/mol
LogP-0.01
Rot. Bonds10

About trimethoxy-tris(prop-2-enyl)silylazanium bromide

trimethoxy-tris(prop-2-enyl)silylazanium bromide (PubChem CID 175251728) has the molecular formula C12H24BrNO3Si and a molecular weight of 338.32 g/mol. Its IUPAC name is trimethoxy-tris(prop-2-enyl)silylazanium bromide.

Molecular Properties

Compound Nametrimethoxy-tris(prop-2-enyl)silylazanium bromide
PubChem CID175251728
Molecular FormulaC12H24BrNO3Si
Molecular Weight338.32 g/mol
Exact Mass337.07
IUPAC Nametrimethoxy-tris(prop-2-enyl)silylazanium bromide
SMILESC=CC[Si](CC=C)(CC=C)[N+](OC)(OC)OC.[Br-]
InChIInChI=1S/C12H24NO3Si.BrH/c1-7-10-17(11-8-2,12-9-3)13(14-4,15-5)16-6;/h7-9H,1-3,10-12H2,4-6H3;1H/q+1;/p-1
InChIKeyJLKCPRNGQUDHOC-UHFFFAOYSA-M
XLogP-0.01
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.32
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethoxy-tris(prop-2-enyl)silylazanium bromide?
The IUPAC name of trimethoxy-tris(prop-2-enyl)silylazanium bromide (CID 175251728) is trimethoxy-tris(prop-2-enyl)silylazanium bromide.
What is the SMILES notation for trimethoxy-tris(prop-2-enyl)silylazanium bromide?
The canonical SMILES for trimethoxy-tris(prop-2-enyl)silylazanium bromide is C=CC[Si](CC=C)(CC=C)[N+](OC)(OC)OC.[Br-].
What is the InChIKey of trimethoxy-tris(prop-2-enyl)silylazanium bromide?
The InChIKey is JLKCPRNGQUDHOC-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H24NO3Si.BrH/c1-7-10-17(11-8-2,12-9-3)13(14-4,15-5)16-6;/h7-9H,1-3,10-12H2,4-6H3;1H/q+1;/p-1.
What are the key properties of trimethoxy-tris(prop-2-enyl)silylazanium bromide?
trimethoxy-tris(prop-2-enyl)silylazanium bromide has a molecular weight of 338.32 g/mol, XLogP of -0.01, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-tris(prop-2-enyl)silylazanium bromide is sourced from PubChem (CID 175251728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).