trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane

C9H23O3PSi — CID 91752262

IUPACtrimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane
SMILESCC(C)CCOP(C)(=O)O[Si](C)(C)C
InChIInChI=1S/C9H23O3PSi/c1-9(2)7-8-11-13(3,10)12-14(4,5)6/h9H,7-8H2,1-6H3
InChIKeyYQTQITXZRFIYDA-UHFFFAOYSA-N
MW238.34 g/mol
LogP3.72
Rot. Bonds6

About trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane

trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane (PubChem CID 91752262) has the molecular formula C9H23O3PSi and a molecular weight of 238.34 g/mol. Its IUPAC name is trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane
PubChem CID91752262
Molecular FormulaC9H23O3PSi
Molecular Weight238.34 g/mol
Exact Mass238.12
IUPAC Nametrimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane
SMILESCC(C)CCOP(C)(=O)O[Si](C)(C)C
InChIInChI=1S/C9H23O3PSi/c1-9(2)7-8-11-13(3,10)12-14(4,5)6/h9H,7-8H2,1-6H3
InChIKeyYQTQITXZRFIYDA-UHFFFAOYSA-N
XLogP3.72
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 53.72
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'}

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Related Compounds

trimethyl-[methyl(3-methylpentoxy)phosphoryl]oxysilane
CID 91721359
azanium 3-methylbutyl dihydrogen phosphate
CID 21149534
1-[ethyl(3-methylbutoxy)phosphoryl]oxy-3-methylbutane
CID 170851032
3-methyl-N-[methyl(3-methylbutoxy)phosphoryl]butan-1-amine
CID 148613615
ethane;1-methoxy-3-methylbutane
CID 144580604
methane;[methoxy(methyl)phosphoryl]oxy-trimethylsilane
CID 158342684
3-methylbutoxy(trifluoromethyl)phosphinic acid
CID 154237685
2-methyl-1-[methyl(propoxy)phosphoryl]oxypropane
CID 86168978
1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane
CID 170850888
tris(3,7,11-trimethyldodecyl) phosphate
CID 54444487
3-methylbutyl hypobromite
CID 141146646
1-[methyl(propoxy)phosphoryl]oxypropane
CID 566276

Frequently Asked Questions

What is the IUPAC name of trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane?
The IUPAC name of trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane (CID 91752262) is trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane.
What is the SMILES notation for trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane?
The canonical SMILES for trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane is CC(C)CCOP(C)(=O)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane?
The InChIKey is YQTQITXZRFIYDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23O3PSi/c1-9(2)7-8-11-13(3,10)12-14(4,5)6/h9H,7-8H2,1-6H3.
What are the key properties of trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane?
trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane has a molecular weight of 238.34 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane is sourced from PubChem (CID 91752262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).