Sodium methyl 1-benzyl-1,2,5,6-tetrahydro-4-oxidonicotinate

Base Information

• Chemical Name: Sodium methyl 1-benzyl-1,2,5,6-tetrahydro-4-oxidonicotinate
• CAS No.: 97392-69-3
• Molecular Formula: C14H17 N O3 . Na
• Molecular Weight: 269.27151
• European Community (EC) Number: 306-704-7
• DSSTox Substance ID: DTXSID50242918
• Nikkaji Number: J382.932D
• Mol file: 97392-69-3.mol

Synonyms:Sodium methyl 1-benzyl-1,2,5,6-tetrahydro-4-oxidonicotinate;97392-69-3;EINECS 306-704-7;sodium;1-benzyl-5-methoxycarbonyl-3,6-dihydro-2H-pyridin-4-olate;DTXSID50242918;1,2,5,6-Tetrahydro-1-(phenylmethyl)-4-(sodiooxy)-3-pyridinecarboxylic acid methyl ester

Chemical Property of Sodium methyl 1-benzyl-1,2,5,6-tetrahydro-4-oxidonicotinate

Chemical Property:

• Vapor Pressure: 1.93E-06mmHg at 25°C
• Boiling Point: 379.7°Cat760mmHg
• Flash Point: 183.4°C
• PSA: 52.60000
• Density: g/cm³
• LogP: 1.68780
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 269.10278765
• Heavy Atom Count: 19
• Complexity: 338

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(CCN(C1)CC2=CC=CC=C2)[O-].[Na+]

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