N-benzyl-3-bromo-4-methylbenzenesulfonamide

Base Information

• Chemical Name: N-benzyl-3-bromo-4-methylbenzenesulfonamide
• CAS No.: 850429-67-3
• Molecular Formula: C14H14BrNO2S
• Molecular Weight: 340.241
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID40428441
• Mol file: 850429-67-3.mol

Synonyms:850429-67-3;N-benzyl-3-bromo-4-methylbenzenesulfonamide;N-Benzyl 3-bromo-4-methylbenzenesulfonamide;N-Benzyl-N-3-bromo-4-methylbenzenesulphonamide;3-bromo-4-methyl-N-(phenylmethyl)benzenesulfonamide;SCHEMBL2499052;DTXSID40428441;UDIVRJRBNLDWNI-UHFFFAOYSA-N;MFCD07363832;AKOS015834641;AB30862;BS-24228;CS-0213098;FT-0644918;N-benzyl-3-bromo-4-methyl-benzenesulfonamide;N-benzyl-3-bromo-4-methylbenzene-1-sulfonamide;A841079;3-bromanyl-4-methyl-N-(phenylmethyl)benzenesulfonamide

Chemical Property of N-benzyl-3-bromo-4-methylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 7.89E-09mmHg at 25°C
• Melting Point: 98-101 °C
• Refractive Index: 1.61
• Boiling Point: 465.1 °C at 760 mmHg
• PKA: 10.78±0.50(Predicted)
• Flash Point: 235.1 °C
• PSA: 54.55000
• Density: 1.459 g/cm³
• LogP: 4.70770
• Storage Temp.: Keep Cold
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 338.99286
• Heavy Atom Count: 19
• Complexity: 373

Purity/Quality:

98%min ^*data from raw suppliers

N-Benzyl3-bromo-4-methylbenzenesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)Br