disodium pentacyano(nitroso)irondiuide

• ChemBase ID: 312926
• Molecular Formular: C5FeN6Na2O
• Molecular Mass: 261.91764
• Monoisotopic Mass: 261.92783471
• SMILES: [Fe-2](C#N)(C#N)(C#N)(C#N)(C#N)N=O.[Na+].[Na+]
• Canonical SMILES: O=N[Fe-2](C#N)(C#N)(C#N)(C#N)C#N.[Na+].[Na+]
• InChI: InChI=1S/5CN.Fe.NO.2Na/c5*1-2;;1-2;;/q;;;;;2*-1;2*+1
• InChIKey: FPWUWQVZUNFZQM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: disodium pentacyano(nitroso)irondiuide
• IUPAC Traditional name: disodium nitroprusside
• Synonyms: Sodium Nitroprusside

Database IDs

• CAS Number: 14402-89-2

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): 0.0712
• LogD (pH = 7.4): 0.0712
• Log P: 0.0712
• Molar Refractivity: 39.4351 cm^3
• Polarizability: 15.23474 Å^3
• Polar Surface Area: 148.38 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Pharmacology Properties

• Target: Others

Product Information

• Salt Data: Sodium Salt