2-[(2-bromobenzyl)sulfanyl]-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide

Base Information

• Chemical Name: 2-[(2-bromobenzyl)sulfanyl]-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide
• CAS No.: 5543-40-8
• Molecular Formula: C9H15 N2 O2 P S3
• Molecular Weight: 438.2956
• DSSTox Substance ID: DTXSID70416492
• Mol file: 5543-40-8.mol

Synonyms:5543-40-8;AC1NSIFA;DTXSID70416492;STK698610;AKOS001722013;2-[(2-bromobenzyl)sulfanyl]-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide;2-[(2-bromobenzyl)sulfanyl]-N'~1~-[(E)-1-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide

Chemical Property of 2-[(2-bromobenzyl)sulfanyl]-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]acetohydrazide

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 437.00449
• Heavy Atom Count: 26
• Complexity: 503

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C=NNC(=O)CSCC2=CC=CC=C2Br)[N+](=O)[O-]
• Isomeric SMILES: COC1=C(C=C(C=C1)/C=N/NC(=O)CSCC2=CC=CC=C2Br)[N+](=O)[O-]