di(tricosan-3-yloxy)silane

C46H96O2Si — CID 173236024

IUPACdi(tricosan-3-yloxy)silane
SMILESCCCCCCCCCCCCCCCCCCCCC(CC)O[SiH2]OC(CC)CCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C46H96O2Si/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45(7-3)47-49-48-46(8-4)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h45-46H,5-44,49H2,1-4H3
InChIKeySNQZWYBDWOZPLK-UHFFFAOYSA-N
MW709.36 g/mol
LogP16.44
Rot. Bonds44

About di(tricosan-3-yloxy)silane

di(tricosan-3-yloxy)silane (PubChem CID 173236024) has the molecular formula C46H96O2Si and a molecular weight of 709.36 g/mol. Its IUPAC name is di(tricosan-3-yloxy)silane.

Molecular Properties

Compound Namedi(tricosan-3-yloxy)silane
PubChem CID173236024
Molecular FormulaC46H96O2Si
Molecular Weight709.36 g/mol
Exact Mass708.72
IUPAC Namedi(tricosan-3-yloxy)silane
SMILESCCCCCCCCCCCCCCCCCCCCC(CC)O[SiH2]OC(CC)CCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C46H96O2Si/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45(7-3)47-49-48-46(8-4)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h45-46H,5-44,49H2,1-4H3
InChIKeySNQZWYBDWOZPLK-UHFFFAOYSA-N
XLogP16.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds44
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500709.36
LogP ≤ 516.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-icosan-3-yloxyicosane
CID 22595200
3-pentadecan-3-yloxypentadecane
CID 57200588
octan-3-yloxy(3-octan-3-yloxysilylpropyl)silane
CID 123694171
octan-3-yloxy(4-octan-3-yloxysilylbutyl)silane
CID 123952140
tripentadecan-6-yl phosphite
CID 87207088
di(undecan-2-yloxy)silane
CID 123423274
di(decan-2-yloxy)silane
CID 123195552
6-tricosan-6-yloxytricosane
CID 57279617
16-tetratriacontan-16-yloxytetratriacontane
CID 91150918
3-hydroperoxyoctane
CID 22268892
CID 22295533
CID 22295533
ethyl-methyl-octan-3-yloxyphosphane
CID 22628649

Frequently Asked Questions

What is the IUPAC name of di(tricosan-3-yloxy)silane?
The IUPAC name of di(tricosan-3-yloxy)silane (CID 173236024) is di(tricosan-3-yloxy)silane.
What is the SMILES notation for di(tricosan-3-yloxy)silane?
The canonical SMILES for di(tricosan-3-yloxy)silane is CCCCCCCCCCCCCCCCCCCCC(CC)O[SiH2]OC(CC)CCCCCCCCCCCCCCCCCCCC.
What is the InChIKey of di(tricosan-3-yloxy)silane?
The InChIKey is SNQZWYBDWOZPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H96O2Si/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45(7-3)47-49-48-46(8-4)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h45-46H,5-44,49H2,1-4H3.
What are the key properties of di(tricosan-3-yloxy)silane?
di(tricosan-3-yloxy)silane has a molecular weight of 709.36 g/mol, XLogP of 16.44, 44 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for di(tricosan-3-yloxy)silane is sourced from PubChem (CID 173236024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).