Butanoic acid, 6-[[(aminothioxomethyl)hydrazono]methyl]-3-pyridinyl ester

Base Information

• Chemical Name: Butanoic acid, 6-[[(aminothioxomethyl)hydrazono]methyl]-3-pyridinyl ester
• CAS No.: 51984-21-5
• Molecular Formula: C11H14N4O2S
• Molecular Weight: 266.3195
• NSC Number: 185050
• DSSTox Substance ID: DTXSID00429712
• ChEMBL ID: CHEMBL1975724

Synonyms:Butanoic acid, 6-[[(aminothioxomethyl)hydrazono]methyl]-3-pyridinyl ester;51984-21-5;CHEMBL1975724;DTXSID00429712;NSC185050;Butanoic acid, 6-[[(aminothioxomethyl)hydrazone]methyl]-3-pyridinyl ester;NSC-185050;Hydrazinecarbothioamide, 2-[(5-butoxy-2-pyridinyl)methylene]-;[6-[(E)-(carbamothioylhydrazinylidene)methyl]pyridin-3-yl] butanoate

Chemical Property of Butanoic acid, 6-[[(aminothioxomethyl)hydrazono]methyl]-3-pyridinyl ester

Chemical Property:

• Vapor Pressure: 1.35E-07mmHg at 25°C
• Boiling Point: 429.9°Cat760mmHg
• Flash Point: 213.8°C
• Density: 1.3g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 266.08374688
• Heavy Atom Count: 18
• Complexity: 322

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1=CN=C(C=C1)C=NNC(=S)N
• Isomeric SMILES: CCCC(=O)OC1=CN=C(C=C1)/C=N/NC(=S)N

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