oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium

C4H11O6PSi — CID 21125217

IUPACoxido-oxo-(4-trihydroxysilylbutoxy)phosphanium
SMILESO=[P+]([O-])OCCCC[Si](O)(O)O
InChIInChI=1S/C4H11O6PSi/c5-11(6)10-3-1-2-4-12(7,8)9/h7-9H,1-4H2
InChIKeyDVKXMCMEWABLDT-UHFFFAOYSA-N
MW214.19 g/mol
LogP-1.28
Rot. Bonds6

About oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium

oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium (PubChem CID 21125217) has the molecular formula C4H11O6PSi and a molecular weight of 214.19 g/mol. Its IUPAC name is oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium.

Molecular Properties

Compound Nameoxido-oxo-(4-trihydroxysilylbutoxy)phosphanium
PubChem CID21125217
Molecular FormulaC4H11O6PSi
Molecular Weight214.19 g/mol
Exact Mass214.01
IUPAC Nameoxido-oxo-(4-trihydroxysilylbutoxy)phosphanium
SMILESO=[P+]([O-])OCCCC[Si](O)(O)O
InChIInChI=1S/C4H11O6PSi/c5-11(6)10-3-1-2-4-12(7,8)9/h7-9H,1-4H2
InChIKeyDVKXMCMEWABLDT-UHFFFAOYSA-N
XLogP-1.28
TPSA110.05 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

dipotassium bis(4-hydroxybutoxy-oxido-oxophosphanium)
CID 57356188
hydroxy-oxo-(6-phosphooxyhexoxy)phosphanium
CID 22644301
ethane-1,2-diamine;oxido-oxo-(5-phosphooxypentoxy)phosphanium
CID 22174412
bis(dodecoxy-oxido-oxophosphanium);iron(2+)
CID 87602903
oxido-oxo-tetracosoxyphosphanium
CID 57352033
calcium bis(octoxy-oxido-oxophosphanium)
CID 57351629
calcium bis(butoxy-oxido-oxophosphanium)
CID 161238032
dioxido-oxo-(4-trihydroxysilylbutyl)-λ5-phosphane
CID 22719275
4-dihydroxysilylpentoxy-oxido-oxophosphanium
CID 157337187
2-acetamidoethoxy-oxido-oxophosphanium
CID 6372292
hydroxymethoxy-oxido-oxophosphanium
CID 152749176
magnesium bis(oxido-oxo-propoxyphosphanium)
CID 158469666

Frequently Asked Questions

What is the IUPAC name of oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium?
The IUPAC name of oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium (CID 21125217) is oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium.
What is the SMILES notation for oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium?
The canonical SMILES for oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium is O=[P+]([O-])OCCCC[Si](O)(O)O.
What is the InChIKey of oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium?
The InChIKey is DVKXMCMEWABLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O6PSi/c5-11(6)10-3-1-2-4-12(7,8)9/h7-9H,1-4H2.
What are the key properties of oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium?
oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium has a molecular weight of 214.19 g/mol, XLogP of -1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for oxido-oxo-(4-trihydroxysilylbutoxy)phosphanium is sourced from PubChem (CID 21125217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).