Nitroxinil meglumate

Base Information

• Chemical Name: Nitroxinil meglumate
• CAS No.: 10532-59-9
• Deprecated CAS: 14543-12-5
• Molecular Formula: C14H20IN3O8
• Molecular Weight: 485.2284
• UNII: L1534R3VJ6
• DSSTox Substance ID: DTXSID80147083
• Wikidata: Q27282577
• Mol file: 10532-59-9.mol

Synonyms:Nitroxinil meglumate;Fasciolid;Fasciolid (pharmaceutical);UNII-L1534R3VJ6;10532-59-9;L1534R3VJ6;4-hydroxy-3-iodo-5-nitrobenzonitrile;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;NITROXINIL MEGLUMINE;NITROXYNIL MEGLUMINE;NIOSH/DI4607000;DTXSID80147083;C7H17NO5.C7H3IN2O3;M & B 10755 N-Methylglucamine salt;M & B 10755A;DI46070000;C7-H17-N-O5.C7-H3-I-N2-O3;NITROXYNIL D-N-METHYLGLUCAMINE SALT [MI];Q27282577;36508-79-9

Chemical Property of Nitroxinil meglumate

Chemical Property:

• Vapor Pressure: 1.12E-11mmHg at 25°C
• Boiling Point: 490.4°Cat760mmHg
• Flash Point: 251.6°C
• PSA: 203.02000
• Density: g/cm³
• LogP: -0.66752
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 6
• Exact Mass: 485.02951
• Heavy Atom Count: 26
• Complexity: 390

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCC(C(C(C(CO)O)O)O)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)I)C#N
• Isomeric SMILES: CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)I)C#N

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