Acetic acid 2-nitro-3-[4-methyl-3-nitrophenyl]-2-propenyl ester

Base Information

• Chemical Name: Acetic acid 2-nitro-3-[4-methyl-3-nitrophenyl]-2-propenyl ester
• CAS No.: 114430-18-1
• Molecular Formula: C12H12 N2 O6
• Molecular Weight: 280.2335
• Nikkaji Number: J385.137K
• Mol file: 114430-18-1.mol

Synonyms:2-Propen-1-ol, 3-(4-methyl-3-nitrophenyl)-2-nitro-, acetate (ester);114430-18-1;Acetic acid 2-nitro-3-[4-methyl-3-nitrophenyl]-2-propenyl ester

Chemical Property of Acetic acid 2-nitro-3-[4-methyl-3-nitrophenyl]-2-propenyl ester

Chemical Property:

• Vapor Pressure: 5.4E-09mmHg at 25°C
• Boiling Point: 469.7°Cat760mmHg
• Flash Point: 214°C
• Density: 1.349g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 280.06953611
• Heavy Atom Count: 20
• Complexity: 423

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C=C(COC(=O)C)[N+](=O)[O-])[N+](=O)[O-]
• Isomeric SMILES: CC1=C(C=C(C=C1)/C=C(/COC(=O)C)\[N+](=O)[O-])[N+](=O)[O-]