praseodymium(3+);triacetate;trihydrate

C6H15O9Pr — CID 172733090

IUPACpraseodymium(3+);triacetate;trihydrate
SMILESCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.[Pr+3]
InChIInChI=1S/3C2H4O2.3H2O.Pr/c3*1-2(3)4;;;;/h3*1H3,(H,3,4);3*1H2;/q;;;;;;+3/p-3
InChIKeyIBFISXYVDNGZJC-UHFFFAOYSA-K
MW372.09 g/mol
LogP-6.21
Rot. Bonds

About praseodymium(3+);triacetate;trihydrate

praseodymium(3+);triacetate;trihydrate (PubChem CID 172733090) has the molecular formula C6H15O9Pr and a molecular weight of 372.09 g/mol. Its IUPAC name is praseodymium(3+);triacetate;trihydrate.

Molecular Properties

Compound Namepraseodymium(3+);triacetate;trihydrate
PubChem CID172733090
Molecular FormulaC6H15O9Pr
Molecular Weight372.09 g/mol
Exact Mass371.98
IUPAC Namepraseodymium(3+);triacetate;trihydrate
SMILESCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.[Pr+3]
InChIInChI=1S/3C2H4O2.3H2O.Pr/c3*1-2(3)4;;;;/h3*1H3,(H,3,4);3*1H2;/q;;;;;;+3/p-3
InChIKeyIBFISXYVDNGZJC-UHFFFAOYSA-K
XLogP-6.21
TPSA214.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.09
LogP ≤ 5-6.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze praseodymium(3+);triacetate;trihydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cerium(3+);acetate;hexahydrate
CID 23158452
yttrium(3+);triacetate;hydrate
CID 57376990
vanadium;triacetate;hydrate
CID 102418603
sodium;acetate;trihydrate
CID 23665404
iron(2+);diacetate;heptahydrate
CID 173209391
CID 170997536
CID 170997536
zinc;diacetate;heptahydrate
CID 161319738
tin(2+);diacetate;dihydrate
CID 174049693
strontium;acetate;hexahydrate
CID 19795582
cobalt(2+);acetate;hexahydrate
CID 21479533
uranium;hexaacetate;hydrate
CID 174392556
cesium;acetate;dihydrate
CID 175372370

Frequently Asked Questions

What is the IUPAC name of praseodymium(3+);triacetate;trihydrate?
The IUPAC name of praseodymium(3+);triacetate;trihydrate (CID 172733090) is praseodymium(3+);triacetate;trihydrate.
What is the SMILES notation for praseodymium(3+);triacetate;trihydrate?
The canonical SMILES for praseodymium(3+);triacetate;trihydrate is CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.[Pr+3].
What is the InChIKey of praseodymium(3+);triacetate;trihydrate?
The InChIKey is IBFISXYVDNGZJC-UHFFFAOYSA-K. The full InChI is InChI=1S/3C2H4O2.3H2O.Pr/c3*1-2(3)4;;;;/h3*1H3,(H,3,4);3*1H2;/q;;;;;;+3/p-3.
What are the key properties of praseodymium(3+);triacetate;trihydrate?
praseodymium(3+);triacetate;trihydrate has a molecular weight of 372.09 g/mol, XLogP of -6.21, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for praseodymium(3+);triacetate;trihydrate is sourced from PubChem (CID 172733090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).