(E)-N-(2-ethylphenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide

Base Information

• Chemical Name: (E)-N-(2-ethylphenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide
• CAS No.: 476316-58-2
• Molecular Formula: C15H14N2O3S
• Molecular Weight: 302.35
• European Community (EC) Number: 809-286-9
• Mol file: 476316-58-2.mol

Synonyms:(E)-N-(2-ethylphenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide;476316-58-2;NID-1;NID-1, >=98% (HPLC);SR-01000006211;SR-01000006211-1

Chemical Property of (E)-N-(2-ethylphenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide

Chemical Property:

• PSA: 103.16000
• LogP: 4.46680
• Storage Temp.: 2-8°C
• Solubility.: DMSO: soluble25mg/mL, clear
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 302.07251349
• Heavy Atom Count: 21
• Complexity: 408

Purity/Quality:

99% ^*data from raw suppliers

NID-1 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

Useful:

• Canonical SMILES: CCC1=CC=CC=C1NC(=O)C=CC2=CC=C(S2)[N+](=O)[O-]
• Isomeric SMILES: CCC1=CC=CC=C1NC(=O)/C=C/C2=CC=C(S2)[N+](=O)[O-]

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