Phenyl 4,5-dimethoxy-2-nitrobenzoate

Base Information

• Chemical Name: Phenyl 4,5-dimethoxy-2-nitrobenzoate
• CAS No.: 100905-32-6
• Molecular Formula: C₁₅H₁₃NO₆
• Molecular Weight: 303.271
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID50429227
• Wikidata: Q72468141
• Mol file: 100905-32-6.mol

Synonyms:phenyl 4,5-dimethoxy-2-nitrobenzoate;100905-32-6;Phenyl4,5-dimethoxy-2-nitrobenzoate;DTXSID50429227;FT-0660488;4,5-Dimethoxy-2-nitrobenzoic acid phenyl ester

Chemical Property of Phenyl 4,5-dimethoxy-2-nitrobenzoate

Chemical Property:

• Appearance/Colour: white to off-white powder
• Boiling Point: 487.234 °C at 760 mmHg
• Flash Point: 215.312 °C
• PSA: 90.58000
• Density: 1.303 g/cm³
• LogP: 3.35440
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 303.07428713
• Heavy Atom Count: 22
• Complexity: 390

Purity/Quality:

99% ^*data from raw suppliers

Phenyl4,5-dimethoxy-2-nitrobenzoate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C(=C1)C(=O)OC2=CC=CC=C2)[N+](=O)[O-])OC