N-(1,3-benzodioxol-5-ylmethyl)-2-phenylbutanamide

Base Information

• Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenylbutanamide
• CAS No.: 6587-75-3
• Molecular Formula: C39H26 Cl3 N15 O12 S3
• Molecular Weight: 297.3484
• DSSTox Substance ID: DTXSID50387696

Synonyms:6587-75-3;ST036718;Oprea1_459601;Oprea1_490973;N-(1,3-benzodioxol-5-ylmethyl)-2-phenylbutanamide;DTXSID50387696;STK099118;AKOS000648492;AKOS017049048;N~1~-(1,3-benzodioxol-5-ylmethyl)-2-phenylbutanamide

Chemical Property of N-(1,3-benzodioxol-5-ylmethyl)-2-phenylbutanamide

Chemical Property:

• Vapor Pressure: 1.64E-10mmHg at 25°C
• Boiling Point: 509.8°C at 760 mmHg
• Flash Point: 262.1°C
• Density: 1.187g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 297.13649347
• Heavy Atom Count: 22
• Complexity: 367

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1=CC=CC=C1)C(=O)NCC2=CC3=C(C=C2)OCO3

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