erbium(3+);trinitrate;tetrahydrate

H8ErN3O13 — CID 172858515

IUPACerbium(3+);trinitrate;tetrahydrate
SMILESO.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Er+3]
InChIInChI=1S/Er.3NO3.4H2O/c;3*2-1(3)4;;;;/h;;;;4*1H2/q+3;3*-1;;;;
InChIKeyZAPNJRNVKLRYDC-UHFFFAOYSA-N
MW425.33 g/mol
LogP-4.02
Rot. Bonds

About erbium(3+);trinitrate;tetrahydrate

erbium(3+);trinitrate;tetrahydrate (PubChem CID 172858515) has the molecular formula H8ErN3O13 and a molecular weight of 425.33 g/mol. Its IUPAC name is erbium(3+);trinitrate;tetrahydrate.

Molecular Properties

Compound Nameerbium(3+);trinitrate;tetrahydrate
PubChem CID172858515
Molecular FormulaH8ErN3O13
Molecular Weight425.33 g/mol
Exact Mass423.94
IUPAC Nameerbium(3+);trinitrate;tetrahydrate
SMILESO.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Er+3]
InChIInChI=1S/Er.3NO3.4H2O/c;3*2-1(3)4;;;;/h;;;;4*1H2/q+3;3*-1;;;;
InChIKeyZAPNJRNVKLRYDC-UHFFFAOYSA-N
XLogP-4.02
TPSA324.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.33
LogP ≤ 5-4.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze erbium(3+);trinitrate;tetrahydrate 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

platinum(2+);dinitrate;hydrate
CID 172723097
beryllium;nitrate;tetrahydrate
CID 19806872
ytterbium;nitrate;tetrahydrate
CID 18185938
bis(yttrium(3+));hexanitrate;heptahydrate
CID 139054016
holmium;nitrate;trihydrate
CID 173334305
rhodium(3+);trinitrate;hexahydrate
CID 159957090
cobalt;nitrate;tetrahydrate
CID 173115320
dysprosium(3+);trinitrate;pentahydrate
CID 91886635
dibismuth;hexanitrate;pentahydrate
CID 158893805
sodium;nitrate;tetrahydrate
CID 162201136
calcium;nitrate;hexahydrate
CID 22138076
dicalcium;tetranitrate;tetrahydrate
CID 157337195

Frequently Asked Questions

What is the IUPAC name of erbium(3+);trinitrate;tetrahydrate?
The IUPAC name of erbium(3+);trinitrate;tetrahydrate (CID 172858515) is erbium(3+);trinitrate;tetrahydrate.
What is the SMILES notation for erbium(3+);trinitrate;tetrahydrate?
The canonical SMILES for erbium(3+);trinitrate;tetrahydrate is O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Er+3].
What is the InChIKey of erbium(3+);trinitrate;tetrahydrate?
The InChIKey is ZAPNJRNVKLRYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/Er.3NO3.4H2O/c;3*2-1(3)4;;;;/h;;;;4*1H2/q+3;3*-1;;;;.
What are the key properties of erbium(3+);trinitrate;tetrahydrate?
erbium(3+);trinitrate;tetrahydrate has a molecular weight of 425.33 g/mol, XLogP of -4.02, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for erbium(3+);trinitrate;tetrahydrate is sourced from PubChem (CID 172858515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).