neodymium;nitrate;pentahydrate

H10NNdO8- — CID 173320281

IUPACneodymium;nitrate;pentahydrate
SMILESO.O.O.O.O.O=[N+]([O-])[O-].[Nd]
InChIInChI=1S/NO3.Nd.5H2O/c2-1(3)4;;;;;;/h;;5*1H2/q-1;;;;;;
InChIKeyBEHMBFNTZVFKDX-UHFFFAOYSA-N
MW296.32 g/mol
LogP-4.36
Rot. Bonds

About neodymium;nitrate;pentahydrate

neodymium;nitrate;pentahydrate (PubChem CID 173320281) has the molecular formula H10NNdO8- and a molecular weight of 296.32 g/mol. Its IUPAC name is neodymium;nitrate;pentahydrate.

Molecular Properties

Compound Nameneodymium;nitrate;pentahydrate
PubChem CID173320281
Molecular FormulaH10NNdO8-
Molecular Weight296.32 g/mol
Exact Mass293.95
IUPAC Nameneodymium;nitrate;pentahydrate
SMILESO.O.O.O.O.O=[N+]([O-])[O-].[Nd]
InChIInChI=1S/NO3.Nd.5H2O/c2-1(3)4;;;;;;/h;;5*1H2/q-1;;;;;;
InChIKeyBEHMBFNTZVFKDX-UHFFFAOYSA-N
XLogP-4.36
TPSA223.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 5-4.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of neodymium;nitrate;pentahydrate?
The IUPAC name of neodymium;nitrate;pentahydrate (CID 173320281) is neodymium;nitrate;pentahydrate.
What is the SMILES notation for neodymium;nitrate;pentahydrate?
The canonical SMILES for neodymium;nitrate;pentahydrate is O.O.O.O.O.O=[N+]([O-])[O-].[Nd].
What is the InChIKey of neodymium;nitrate;pentahydrate?
The InChIKey is BEHMBFNTZVFKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/NO3.Nd.5H2O/c2-1(3)4;;;;;;/h;;5*1H2/q-1;;;;;;.
What are the key properties of neodymium;nitrate;pentahydrate?
neodymium;nitrate;pentahydrate has a molecular weight of 296.32 g/mol, XLogP of -4.36, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for neodymium;nitrate;pentahydrate is sourced from PubChem (CID 173320281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).