3-(oxan-2-yloxy)propyl-tritritiooxysilane

C8H18O5Si — CID 140697850

IUPAC3-(oxan-2-yloxy)propyl-tritritiooxysilane
SMILES[3H]O[Si](CCCOC1CCCCO1)(O[3H])O[3H]
InChIInChI=1S/C8H18O5Si/c9-14(10,11)7-3-6-13-8-4-1-2-5-12-8/h8-11H,1-7H2/i9T,10T,11T
InChIKeyQWPRIPVLIYVRHL-VOYNCUALSA-N
MW228.34 g/mol
LogP-0.16
Rot. Bonds8

About 3-(oxan-2-yloxy)propyl-tritritiooxysilane

3-(oxan-2-yloxy)propyl-tritritiooxysilane (PubChem CID 140697850) has the molecular formula C8H18O5Si and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-(oxan-2-yloxy)propyl-tritritiooxysilane.

Molecular Properties

Compound Name3-(oxan-2-yloxy)propyl-tritritiooxysilane
PubChem CID140697850
Molecular FormulaC8H18O5Si
Molecular Weight228.34 g/mol
Exact Mass228.12
IUPAC Name3-(oxan-2-yloxy)propyl-tritritiooxysilane
SMILES[3H]O[Si](CCCOC1CCCCO1)(O[3H])O[3H]
InChIInChI=1S/C8H18O5Si/c9-14(10,11)7-3-6-13-8-4-1-2-5-12-8/h8-11H,1-7H2/i9T,10T,11T
InChIKeyQWPRIPVLIYVRHL-VOYNCUALSA-N
XLogP-0.16
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
CID 155771365
trimethyl-[13-(oxan-2-yloxy)tridecyl]silane
CID 86200856
trimethyl-[4-(oxan-2-yloxy)butoxy]silane
CID 11218840
18-(oxan-2-yloxy)octadecylphosphanium iodide
CID 157231904
(2S)-2-(3-chloropropoxy)oxane
CID 36690971
2-(12-bromododecoxy)oxane
CID 11078592
[2-methyl-3-(oxan-2-yloxy)propyl]-tritritiooxysilane
CID 140697805
zinc 2-(3-bromopropoxy)oxane
CID 175895645
2-octacosoxyoxane
CID 11214102
2-(12-chlorododecoxy)oxane
CID 14014573
2-(18-iodooctadecoxy)oxane
CID 86124950
12-(oxan-2-yloxy)dodecan-1-amine
CID 170028710

Frequently Asked Questions

What is the IUPAC name of 3-(oxan-2-yloxy)propyl-tritritiooxysilane?
The IUPAC name of 3-(oxan-2-yloxy)propyl-tritritiooxysilane (CID 140697850) is 3-(oxan-2-yloxy)propyl-tritritiooxysilane.
What is the SMILES notation for 3-(oxan-2-yloxy)propyl-tritritiooxysilane?
The canonical SMILES for 3-(oxan-2-yloxy)propyl-tritritiooxysilane is [3H]O[Si](CCCOC1CCCCO1)(O[3H])O[3H].
What is the InChIKey of 3-(oxan-2-yloxy)propyl-tritritiooxysilane?
The InChIKey is QWPRIPVLIYVRHL-VOYNCUALSA-N. The full InChI is InChI=1S/C8H18O5Si/c9-14(10,11)7-3-6-13-8-4-1-2-5-12-8/h8-11H,1-7H2/i9T,10T,11T.
What are the key properties of 3-(oxan-2-yloxy)propyl-tritritiooxysilane?
3-(oxan-2-yloxy)propyl-tritritiooxysilane has a molecular weight of 228.34 g/mol, XLogP of -0.16, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxan-2-yloxy)propyl-tritritiooxysilane is sourced from PubChem (CID 140697850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).