Benzoic acid, 3-(aminosulfonyl)-4-(2-(3,4-dimethoxyphenyl)ethyl)-5-nitro-

Base Information

• Chemical Name: Benzoic acid, 3-(aminosulfonyl)-4-(2-(3,4-dimethoxyphenyl)ethyl)-5-nitro-
• CAS No.: 72020-10-1
• Molecular Formula: C17H18N2O8S
• Molecular Weight: 410.3984
• DSSTox Substance ID: DTXSID20222308
• Wikidata: Q83100496

Synonyms:3-(Aminosulfonyl)-4-(2-(3,4-dimethoxyphenyl)ethyl)-5-nitrobenzoic acid;Benzoic acid, 3-(aminosulfonyl)-4-(2-(3,4-dimethoxyphenyl)ethyl)-5-nitro-;72020-10-1;C17H18N2O8S;DTXSID20222308;C17-H18-N2-O8-S;LS-36040

Chemical Property of Benzoic acid, 3-(aminosulfonyl)-4-(2-(3,4-dimethoxyphenyl)ethyl)-5-nitro-

Chemical Property:

• Vapor Pressure: 5.26E-16mmHg at 25°C
• Boiling Point: 615.5°C at 760 mmHg
• Flash Point: 326°C
• Density: 1.443g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 410.07838671
• Heavy Atom Count: 28
• Complexity: 659

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)CCC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)[N+](=O)[O-])OC

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