2-hydroxybutylazanide;trichloroplatinum;nitrite

C4H9Cl3N2O3Pt-3 — CID 58445433

IUPAC2-hydroxybutylazanide;trichloroplatinum;nitrite
SMILESCl[Pt](Cl)Cl.O=N[O-].[CH2-]CC(O)C[NH-]
InChIInChI=1S/C4H9NO.3ClH.HNO2.Pt/c1-2-4(6)3-5;;;;2-1-3;/h4-6H,1-3H2;3*1H;(H,2,3);/q-2;;;;;+3/p-4
InChIKeyBDHZLIALRIOFKO-UHFFFAOYSA-J
MW434.56 g/mol
LogP2.94
Rot. Bonds2

About 2-hydroxybutylazanide;trichloroplatinum;nitrite

2-hydroxybutylazanide;trichloroplatinum;nitrite (PubChem CID 58445433) has the molecular formula C4H9Cl3N2O3Pt-3 and a molecular weight of 434.56 g/mol. Its IUPAC name is 2-hydroxybutylazanide;trichloroplatinum;nitrite.

Molecular Properties

Compound Name2-hydroxybutylazanide;trichloroplatinum;nitrite
PubChem CID58445433
Molecular FormulaC4H9Cl3N2O3Pt-3
Molecular Weight434.56 g/mol
Exact Mass432.93
IUPAC Name2-hydroxybutylazanide;trichloroplatinum;nitrite
SMILESCl[Pt](Cl)Cl.O=N[O-].[CH2-]CC(O)C[NH-]
InChIInChI=1S/C4H9NO.3ClH.HNO2.Pt/c1-2-4(6)3-5;;;;2-1-3;/h4-6H,1-3H2;3*1H;(H,2,3);/q-2;;;;;+3/p-4
InChIKeyBDHZLIALRIOFKO-UHFFFAOYSA-J
XLogP2.94
TPSA96.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.56
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

butan-2-ylazanide;trichloroplatinum;nitrite
CID 58445435
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sodium;propane-1,2-diol;nitrite
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thorium nitrite
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lead(2+) nitrite
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lithium nitrite
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CID 20981982
CID 20981982
nickel(2+) dinitrite
CID 20831815
platinum(2+) dinitrite
CID 173066293
trans-(1R,2R)-cyclohexane-1,2-diamine;trichloroplatinum;nitrite
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Frequently Asked Questions

What is the IUPAC name of 2-hydroxybutylazanide;trichloroplatinum;nitrite?
The IUPAC name of 2-hydroxybutylazanide;trichloroplatinum;nitrite (CID 58445433) is 2-hydroxybutylazanide;trichloroplatinum;nitrite.
What is the SMILES notation for 2-hydroxybutylazanide;trichloroplatinum;nitrite?
The canonical SMILES for 2-hydroxybutylazanide;trichloroplatinum;nitrite is Cl[Pt](Cl)Cl.O=N[O-].[CH2-]CC(O)C[NH-].
What is the InChIKey of 2-hydroxybutylazanide;trichloroplatinum;nitrite?
The InChIKey is BDHZLIALRIOFKO-UHFFFAOYSA-J. The full InChI is InChI=1S/C4H9NO.3ClH.HNO2.Pt/c1-2-4(6)3-5;;;;2-1-3;/h4-6H,1-3H2;3*1H;(H,2,3);/q-2;;;;;+3/p-4.
What are the key properties of 2-hydroxybutylazanide;trichloroplatinum;nitrite?
2-hydroxybutylazanide;trichloroplatinum;nitrite has a molecular weight of 434.56 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxybutylazanide;trichloroplatinum;nitrite is sourced from PubChem (CID 58445433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).