samarium trinitrate

N3O9Sm-3 — CID 21321193

IUPACsamarium trinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Sm]
InChIInChI=1S/3NO3.Sm/c3*2-1(3)4;/q3*-1;
InChIKeyTYMONKCOIVSIBW-UHFFFAOYSA-N
MW336.37 g/mol
LogP-0.72
Rot. Bonds

About samarium trinitrate

samarium trinitrate (PubChem CID 21321193) has the molecular formula N3O9Sm-3 and a molecular weight of 336.37 g/mol. Its IUPAC name is samarium trinitrate.

Molecular Properties

Compound Namesamarium trinitrate
PubChem CID21321193
Molecular FormulaN3O9Sm-3
Molecular Weight336.37 g/mol
Exact Mass337.88
IUPAC Namesamarium trinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Sm]
InChIInChI=1S/3NO3.Sm/c3*2-1(3)4;/q3*-1;
InChIKeyTYMONKCOIVSIBW-UHFFFAOYSA-N
XLogP-0.72
TPSA198.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 5-0.72
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'}

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Related Compounds

europium(3+) trinitrate
CID 24983
technetium(7+) heptanitrate
CID 23031034
niobium(3+) trinitrate
CID 14693735
ruthenium(3+) nitrate
CID 21124620
aluminum trinitrate
CID 26053
platinum pentanitrate
CID 173027999
tetrakis(lanthanum(3+));trinitrate
CID 19804472
gold dinitrate
CID 161234525
zinc dinitrate
CID 24518
bis(osmium(4+));octanitrate
CID 158143113
palladium(2+) nitrate
CID 15793330
ruthenium(4+) tetranitrate
CID 15607735

Frequently Asked Questions

What is the IUPAC name of samarium trinitrate?
The IUPAC name of samarium trinitrate (CID 21321193) is samarium trinitrate.
What is the SMILES notation for samarium trinitrate?
The canonical SMILES for samarium trinitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Sm].
What is the InChIKey of samarium trinitrate?
The InChIKey is TYMONKCOIVSIBW-UHFFFAOYSA-N. The full InChI is InChI=1S/3NO3.Sm/c3*2-1(3)4;/q3*-1;.
What are the key properties of samarium trinitrate?
samarium trinitrate has a molecular weight of 336.37 g/mol, XLogP of -0.72, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for samarium trinitrate is sourced from PubChem (CID 21321193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).