2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

C4H13Cl3O4Si4 — CID 123557269

IUPAC2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESC[SiH]1O[Si](C)(C)O[Si](C)(Cl)O[Si](Cl)(Cl)O1
InChIInChI=1S/C4H13Cl3O4Si4/c1-12-8-13(2,3)10-14(4,5)11-15(6,7)9-12/h12H,1-4H3
InChIKeyLXSNALGZZUPIJQ-UHFFFAOYSA-N
MW343.85 g/mol
LogP2.34
Rot. Bonds

About 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 123557269) has the molecular formula C4H13Cl3O4Si4 and a molecular weight of 343.85 g/mol. Its IUPAC name is 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

Compound Name2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
PubChem CID123557269
Molecular FormulaC4H13Cl3O4Si4
Molecular Weight343.85 g/mol
Exact Mass341.90
IUPAC Name2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESC[SiH]1O[Si](C)(C)O[Si](C)(Cl)O[Si](Cl)(Cl)O1
InChIInChI=1S/C4H13Cl3O4Si4/c1-12-8-13(2,3)10-14(4,5)11-15(6,7)9-12/h12H,1-4H3
InChIKeyLXSNALGZZUPIJQ-UHFFFAOYSA-N
XLogP2.34
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.85
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane with MolForge

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Related Compounds

N,N-diethyl-2,4,4,6,8,8-hexamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-amine
CID 175187862
2-chloro-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 154027680
2,2,4,6,8,10-hexamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
CID 176847521
2,4-dihydroxy-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 174249052
2-N,2-N,4-N,4-N-tetraethyl-2,4,6-trimethyl-1,3,5,2,4,6-trioxatrisilinane-2,4-diamine
CID 155623519
dimethyl-[methyl(trimethylsilyloxy)silyl]oxy-trimethylsilyloxysilane;2,2,4,6,6,8-hexamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane;2,2,4,4,6-pentamethyl-1,3,5,2,4,6-trioxatrisilinane;trimethyl-[methyl(trimethylsilyloxy)silyl]oxysilane
CID 157475832
2-N,2-N,4-N,4-N,2,4,6-heptamethyl-1,3,5,2,4,6-trioxatrisilinane-2,4-diamine
CID 155623501
2,2,4,4,6,6,8-heptamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane;triphenylphosphane
CID 175559013
2,4,6,8-tetramethyl-2,6-di(propan-2-yl)-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 161413479
2,4,6,8-tetramethyl-2,6-dipropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 123389963
2,2,4,4,6,6,8,8,10,10,12,12,14,14,16,16,18,18,20,20,22,22,24,24,26,26,28,28,30,30,32,32,34,34,36,36,38,38,40,40,42,42,44,44,46,46,48,48,50,50,52,52,54,54,56,56,58,58-octapentacontamethyl-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57-nonacosaoxa-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosasilacyclooctapentacontane
CID 528782
2,6-dichloro-2,4,6,8-tetramethyl-4,8-dipropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 54569917

Frequently Asked Questions

What is the IUPAC name of 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The IUPAC name of 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 123557269) is 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.
What is the SMILES notation for 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The canonical SMILES for 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is C[SiH]1O[Si](C)(C)O[Si](C)(Cl)O[Si](Cl)(Cl)O1.
What is the InChIKey of 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The InChIKey is LXSNALGZZUPIJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13Cl3O4Si4/c1-12-8-13(2,3)10-14(4,5)11-15(6,7)9-12/h12H,1-4H3.
What are the key properties of 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane has a molecular weight of 343.85 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4-trichloro-4,6,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 123557269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).