(3-Chloro-2,6-dimethoxyphenyl)(ethoxyimino)methyl benzoate

Base Information

• Chemical Name: (3-Chloro-2,6-dimethoxyphenyl)(ethoxyimino)methyl benzoate
• CAS No.: 29356-13-6
• Molecular Formula: C18H18ClNO5
• Molecular Weight: 363.8
• European Community (EC) Number: 249-439-1
• DSSTox Substance ID: DTXSID00418661
• Nikkaji Number: J3.486J
• Wikidata: Q81977984
• Metabolomics Workbench ID: 56013

Synonyms:benzomate;benzoximate

Chemical Property of (3-Chloro-2,6-dimethoxyphenyl)(ethoxyimino)methyl benzoate

Chemical Property:

• Vapor Pressure: 9.2mmHg at 25°C
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 363.0873504
• Heavy Atom Count: 25
• Complexity: 453

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCON=C(C1=C(C=CC(=C1OC)Cl)OC)OC(=O)C2=CC=CC=C2
• Isomeric SMILES: CCO/N=C(\C1=C(C=CC(=C1OC)Cl)OC)/OC(=O)C2=CC=CC=C2

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