Propan-2-yl 2-[2-(2-nitrophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Base Information

• Chemical Name: Propan-2-yl 2-[2-(2-nitrophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
• CAS No.: 5807-45-4
• Molecular Formula: C20H22N2O6S
• Molecular Weight: 418.4635
• DSSTox Substance ID: DTXSID40411116
• Wikidata: Q82217613

Synonyms:5807-45-4;Propan-2-yl 2-[2-(2-nitrophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;DTXSID40411116;AKOS001731128;EU-0053025;SR-01000535860;SR-01000535860-1

Chemical Property of Propan-2-yl 2-[2-(2-nitrophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Chemical Property:

• Vapor Pressure: 7.17E-18mmHg at 25°C
• Boiling Point: 671.1°Cat760mmHg
• Flash Point: 359.7°C
• Density: 1.348g/cm³
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 418.11985760
• Heavy Atom Count: 29
• Complexity: 610

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

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