CID 20793302

C24H56O8Si6 — CID 20793302

IUPAC—
SMILESCCO[Si](CC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si]C)(OCC)OCC
InChIInChI=1S/C24H56O8Si6/c1-12-25-38(26-13-2,27-14-3)20-19-37(11,30-34(5,6)7)32-36(10,31-35(8,9)29-33-4)18-17-22-15-16-23-24(21-22)28-23/h22-24H,12-21H2,1-11H3
InChIKeyVEFHYXQEONCIJH-UHFFFAOYSA-N
MW641.22 g/mol
LogP6.41
Rot. Bonds20

About CID 20793302

CID 20793302 (PubChem CID 20793302) has the molecular formula C24H56O8Si6 and a molecular weight of 641.22 g/mol.

Molecular Properties

Compound NameCID 20793302
PubChem CID20793302
Molecular FormulaC24H56O8Si6
Molecular Weight641.22 g/mol
Exact Mass640.26
IUPAC Name—
SMILESCCO[Si](CC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si]C)(OCC)OCC
InChIInChI=1S/C24H56O8Si6/c1-12-25-38(26-13-2,27-14-3)20-19-37(11,30-34(5,6)7)32-36(10,31-35(8,9)29-33-4)18-17-22-15-16-23-24(21-22)28-23/h22-24H,12-21H2,1-11H3
InChIKeyVEFHYXQEONCIJH-UHFFFAOYSA-N
XLogP6.41
TPSA77.14 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds20
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500641.22
LogP ≤ 56.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

triethoxy-[2-[(1R,3R,6S)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99738442
CID 20793304
CID 20793304
[dimethyl(trimethylsilyloxy)silyl]oxy-[methoxy(dimethyl)silyl]oxy-methyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane
CID 18710036
triethoxy(propyl)silane;trimethoxy-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane
CID 175326463
[dimethyl(silyl)silyl]oxy-[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane
CID 158590504
[dimethyl-[3-(7-oxabicyclo[4.1.0]heptan-3-yl)propyl]silyl]oxy-[dimethyl-[3-(7-oxabicyclo[4.1.0]heptan-3-yl)propylsilyloxy]silyl]oxy-methyl-(2-triethoxysilylethyl)silane
CID 123270438
triethoxy-[[ethoxy-methyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]methyl]silane
CID 140798704
bis[[dimethoxy-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy]-dimethylsilane
CID 59882614
[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
CID 101151102
3-(7-oxabicyclo[4.1.0]heptan-3-yl)propyl-tripropoxysilane
CID 21267597
[dimethyl-[2-[(1R,3R,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silyl]oxy-dimethyl-[2-[(1R,3S,6S)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99774414
[dimethyl-[2-[(1R,3R,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silyl]oxy-dimethyl-[2-[(1R,3S,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99774411

Frequently Asked Questions

What is the IUPAC name of CID 20793302?
The IUPAC name of CID 20793302 (CID 20793302) is not available.
What is the SMILES notation for CID 20793302?
The canonical SMILES for CID 20793302 is CCO[Si](CC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCC1CCC2OC2C1)O[Si](C)(C)O[Si]C)(OCC)OCC.
What is the InChIKey of CID 20793302?
The InChIKey is VEFHYXQEONCIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H56O8Si6/c1-12-25-38(26-13-2,27-14-3)20-19-37(11,30-34(5,6)7)32-36(10,31-35(8,9)29-33-4)18-17-22-15-16-23-24(21-22)28-23/h22-24H,12-21H2,1-11H3.
What are the key properties of CID 20793302?
CID 20793302 has a molecular weight of 641.22 g/mol, XLogP of 6.41, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20793302 is sourced from PubChem (CID 20793302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).