chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane

C7H20Cl3NOSi3 — CID 133064057

IUPACchloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane
SMILESC[Si](C)(C)N[Si](C)(CCl)O[Si](C)(Cl)CCl
InChIInChI=1S/C7H20Cl3NOSi3/c1-13(2,3)11-15(5,7-9)12-14(4,10)6-8/h11H,6-7H2,1-5H3
InChIKeyVAAHKXTYYPQZFV-UHFFFAOYSA-N
MW324.86 g/mol
LogP3.37
Rot. Bonds6

About chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane

chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane (PubChem CID 133064057) has the molecular formula C7H20Cl3NOSi3 and a molecular weight of 324.86 g/mol. Its IUPAC name is chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane.

Molecular Properties

Compound Namechloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane
PubChem CID133064057
Molecular FormulaC7H20Cl3NOSi3
Molecular Weight324.86 g/mol
Exact Mass322.99
IUPAC Namechloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane
SMILESC[Si](C)(C)N[Si](C)(CCl)O[Si](C)(Cl)CCl
InChIInChI=1S/C7H20Cl3NOSi3/c1-13(2,3)11-15(5,7-9)12-14(4,10)6-8/h11H,6-7H2,1-5H3
InChIKeyVAAHKXTYYPQZFV-UHFFFAOYSA-N
XLogP3.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.86
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane?
The IUPAC name of chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane (CID 133064057) is chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane.
What is the SMILES notation for chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane?
The canonical SMILES for chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane is C[Si](C)(C)N[Si](C)(CCl)O[Si](C)(Cl)CCl.
What is the InChIKey of chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane?
The InChIKey is VAAHKXTYYPQZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20Cl3NOSi3/c1-13(2,3)11-15(5,7-9)12-14(4,10)6-8/h11H,6-7H2,1-5H3.
What are the key properties of chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane?
chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane has a molecular weight of 324.86 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[[chloro-(chloromethyl)-methylsilyl]oxy-methyl-(trimethylsilylamino)silyl]methane is sourced from PubChem (CID 133064057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).