(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane

H3O5PSi — CID 159459331

IUPAC(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane
SMILESO=P1(O[SiH3])OOO1
InChIInChI=1S/H3O5PSi/c1-6(5-7)3-2-4-6/h7H3
InChIKeyLUJRQDDJWFCANL-UHFFFAOYSA-N
MW142.08 g/mol
LogP-0.72
Rot. Bonds1

About (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane

(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane (PubChem CID 159459331) has the molecular formula H3O5PSi and a molecular weight of 142.08 g/mol. Its IUPAC name is (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane.

Molecular Properties

Compound Name(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane
PubChem CID159459331
Molecular FormulaH3O5PSi
Molecular Weight142.08 g/mol
Exact Mass141.95
IUPAC Name(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane
SMILESO=P1(O[SiH3])OOO1
InChIInChI=1S/H3O5PSi/c1-6(5-7)3-2-4-6/h7H3
InChIKeyLUJRQDDJWFCANL-UHFFFAOYSA-N
XLogP-0.72
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.08
LogP ≤ 5-0.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

O-(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)hydroxylamine
CID 173422527
copper;lithium;tris(4-oxido-1,2,3,4λ5-trioxaphosphetane 4-oxide)
CID 175330691
3-ethylperoxy-6-methyl-1,2,4,5,3λ5-tetraoxaphosphinane 3-oxide
CID 142684303
disodium;hydride;5-hydroxy-1,2,3,4,5λ5-tetraoxaphospholane 5-oxide
CID 173145201
dinitro(silyloxy)silane
CID 173313410
CID 159135033
CID 159135033
4-methoxy-1,3,2,4λ5-dioxathiaphosphetane 4-oxide
CID 70637206
oxo-[(2-oxo-1,3,2λ5,4-dioxaphosphagermetan-2-yl)oxy]alumane
CID 173374245
methanol;2,4,6-trihydroxy-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide
CID 174239066
silyloxyaluminum(2+) dinitrate
CID 175162529
dimethyl-[methyl(silyloxy)silyl]oxy-silyloxysilane
CID 173456632
O-(4,6,8,10,12-pentahydroxy-2,4,6,8,10,12-hexaoxo-1,3,5,7,9,11-hexaoxa-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododec-2-yl)hydroxylamine
CID 173394555

Frequently Asked Questions

What is the IUPAC name of (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane?
The IUPAC name of (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane (CID 159459331) is (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane.
What is the SMILES notation for (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane?
The canonical SMILES for (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane is O=P1(O[SiH3])OOO1.
What is the InChIKey of (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane?
The InChIKey is LUJRQDDJWFCANL-UHFFFAOYSA-N. The full InChI is InChI=1S/H3O5PSi/c1-6(5-7)3-2-4-6/h7H3.
What are the key properties of (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane?
(4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane has a molecular weight of 142.08 g/mol, XLogP of -0.72, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-oxo-1,2,3,4λ5-trioxaphosphetan-4-yl)oxysilane is sourced from PubChem (CID 159459331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).