bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane

C26H56O6Si5 — CID 102070616

IUPACbis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane
SMILESC[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CCC2OC2C1
InChIInChI=1S/C26H56O6Si5/c1-33(2,17-15-21-11-13-23-25(19-21)27-23)29-35(5,6)31-37(9,10)32-36(7,8)30-34(3,4)18-16-22-12-14-24-26(20-22)28-24/h21-26H,11-20H2,1-10H3
InChIKeyLZOFCSIVPONNAC-UHFFFAOYSA-N
MW605.16 g/mol
LogP7.48
Rot. Bonds14

About bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane

bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane (PubChem CID 102070616) has the molecular formula C26H56O6Si5 and a molecular weight of 605.16 g/mol. Its IUPAC name is bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane.

Molecular Properties

Compound Namebis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane
PubChem CID102070616
Molecular FormulaC26H56O6Si5
Molecular Weight605.16 g/mol
Exact Mass604.29
IUPAC Namebis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane
SMILESC[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CCC2OC2C1
InChIInChI=1S/C26H56O6Si5/c1-33(2,17-15-21-11-13-23-25(19-21)27-23)29-35(5,6)31-37(9,10)32-36(7,8)30-34(3,4)18-16-22-12-14-24-26(20-22)28-24/h21-26H,11-20H2,1-10H3
InChIKeyLZOFCSIVPONNAC-UHFFFAOYSA-N
XLogP7.48
TPSA61.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500605.16
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane?
The IUPAC name of bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane (CID 102070616) is bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane.
What is the SMILES notation for bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane?
The canonical SMILES for bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane is C[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CCC2OC2C1.
What is the InChIKey of bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane?
The InChIKey is LZOFCSIVPONNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H56O6Si5/c1-33(2,17-15-21-11-13-23-25(19-21)27-23)29-35(5,6)31-37(9,10)32-36(7,8)30-34(3,4)18-16-22-12-14-24-26(20-22)28-24/h21-26H,11-20H2,1-10H3.
What are the key properties of bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane?
bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane has a molecular weight of 605.16 g/mol, XLogP of 7.48, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane is sourced from PubChem (CID 102070616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).