praseodymium(3+);triperchlorate;heptahydrate

H14Cl3O19Pr — CID 162540321

IUPACpraseodymium(3+);triperchlorate;heptahydrate
SMILESO.O.O.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pr+3]
InChIInChI=1S/3ClHO4.7H2O.Pr/c3*2-1(3,4)5;;;;;;;;/h3*(H,2,3,4,5);7*1H2;/q;;;;;;;;;;+3/p-3
InChIKeyNKMQZHFSROAYMQ-UHFFFAOYSA-K
MW565.36 g/mol
LogP-20.04
Rot. Bonds

About praseodymium(3+);triperchlorate;heptahydrate

praseodymium(3+);triperchlorate;heptahydrate (PubChem CID 162540321) has the molecular formula H14Cl3O19Pr and a molecular weight of 565.36 g/mol. Its IUPAC name is praseodymium(3+);triperchlorate;heptahydrate.

Molecular Properties

Compound Namepraseodymium(3+);triperchlorate;heptahydrate
PubChem CID162540321
Molecular FormulaH14Cl3O19Pr
Molecular Weight565.36 g/mol
Exact Mass563.83
IUPAC Namepraseodymium(3+);triperchlorate;heptahydrate
SMILESO.O.O.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pr+3]
InChIInChI=1S/3ClHO4.7H2O.Pr/c3*2-1(3,4)5;;;;;;;;/h3*(H,2,3,4,5);7*1H2;/q;;;;;;;;;;+3/p-3
InChIKeyNKMQZHFSROAYMQ-UHFFFAOYSA-K
XLogP-20.04
TPSA497.22 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500565.36
LogP ≤ 5-20.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Frequently Asked Questions

What is the IUPAC name of praseodymium(3+);triperchlorate;heptahydrate?
The IUPAC name of praseodymium(3+);triperchlorate;heptahydrate (CID 162540321) is praseodymium(3+);triperchlorate;heptahydrate.
What is the SMILES notation for praseodymium(3+);triperchlorate;heptahydrate?
The canonical SMILES for praseodymium(3+);triperchlorate;heptahydrate is O.O.O.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pr+3].
What is the InChIKey of praseodymium(3+);triperchlorate;heptahydrate?
The InChIKey is NKMQZHFSROAYMQ-UHFFFAOYSA-K. The full InChI is InChI=1S/3ClHO4.7H2O.Pr/c3*2-1(3,4)5;;;;;;;;/h3*(H,2,3,4,5);7*1H2;/q;;;;;;;;;;+3/p-3.
What are the key properties of praseodymium(3+);triperchlorate;heptahydrate?
praseodymium(3+);triperchlorate;heptahydrate has a molecular weight of 565.36 g/mol, XLogP of -20.04, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for praseodymium(3+);triperchlorate;heptahydrate is sourced from PubChem (CID 162540321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).