trihydroxyoxidanium;heptahydrate

H17O11+ — CID 57149570

IUPACtrihydroxyoxidanium;heptahydrate
SMILESO.O.O.O.O.O.O.O[O+](O)O
InChIInChI=1S/H3O4.7H2O/c1-4(2)3;;;;;;;/h1-3H;7*1H2/q+1;;;;;;;
InChIKeyHPIBEZMNGHBGLS-UHFFFAOYSA-N
MW193.12 g/mol
LogP-5.82
Rot. Bonds

About trihydroxyoxidanium;heptahydrate

trihydroxyoxidanium;heptahydrate (PubChem CID 57149570) has the molecular formula H17O11+ and a molecular weight of 193.12 g/mol. Its IUPAC name is trihydroxyoxidanium;heptahydrate.

Molecular Properties

Compound Nametrihydroxyoxidanium;heptahydrate
PubChem CID57149570
Molecular FormulaH17O11+
Molecular Weight193.12 g/mol
Exact Mass193.08
IUPAC Nametrihydroxyoxidanium;heptahydrate
SMILESO.O.O.O.O.O.O.O[O+](O)O
InChIInChI=1S/H3O4.7H2O/c1-4(2)3;;;;;;;/h1-3H;7*1H2/q+1;;;;;;;
InChIKeyHPIBEZMNGHBGLS-UHFFFAOYSA-N
XLogP-5.82
TPSA283.89 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.12
LogP ≤ 5-5.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

hydroxy(dioxo)tantalum;pentahydrate
CID 173440153
carbanide;cerium;cerium(3+);methanol;dihydrate
CID 170687555
copper;selenic acid;hydrate
CID 516866
oxidane
CID 173081003
bis(cerium(3+));hydrogen peroxide;tris(oxygen(2-))
CID 157298545
bis(cerium(3+));oxalate;decahydrate
CID 71586987
oxidane
CID 657017
(114C)methanol;hydrate
CID 162324446
hydrogen peroxide;uranium;dihydrate
CID 173422908
cerium(3+);acetate;hexahydrate
CID 23158452
hexakis(2-fluoroethane-1,1-diol);neodymium;tetrahydrate
CID 5232359
cerium(3+);oxygen(2-);acetate;hydrate
CID 172680017

Frequently Asked Questions

What is the IUPAC name of trihydroxyoxidanium;heptahydrate?
The IUPAC name of trihydroxyoxidanium;heptahydrate (CID 57149570) is trihydroxyoxidanium;heptahydrate.
What is the SMILES notation for trihydroxyoxidanium;heptahydrate?
The canonical SMILES for trihydroxyoxidanium;heptahydrate is O.O.O.O.O.O.O.O[O+](O)O.
What is the InChIKey of trihydroxyoxidanium;heptahydrate?
The InChIKey is HPIBEZMNGHBGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/H3O4.7H2O/c1-4(2)3;;;;;;;/h1-3H;7*1H2/q+1;;;;;;;.
What are the key properties of trihydroxyoxidanium;heptahydrate?
trihydroxyoxidanium;heptahydrate has a molecular weight of 193.12 g/mol, XLogP of -5.82, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxyoxidanium;heptahydrate is sourced from PubChem (CID 57149570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).