Cas no 861597-51-5 (2-chloro-N-(4-methylphenyl)butanamide)

2-chloro-N-(4-methylphenyl)butanamide structure
861597-51-5 structure
Product Name:2-chloro-N-(4-methylphenyl)butanamide
CAS No:861597-51-5
MF:C11H14ClNO
MW:211.687962055206
MDL:MFCD02285978
CID:1085831
PubChem ID:17608729
Update Time:2025-04-20

2-chloro-N-(4-methylphenyl)butanamide Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-N-(p-tolyl)butanamide
    • 2-chloro-N-(4-methylphenyl)butanamide
    • BB 0219373
    • BS-36097
    • MFCD02285978
    • DTXSID00589840
    • AKOS006342340
    • 861597-51-5
    • CS-0456398
    • MDL： MFCD02285978
    • Inchi： 1S/C11H14ClNO/c1-3-10(12)11(14)13-9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3,(H,13,14)
    • InChI Key： SRKVFEGDMXEMQK-UHFFFAOYSA-N
    • SMILES： ClC(C(NC1C=CC(C)=CC=1)=O)CC

Computed Properties

  • Exact Mass: 211.0763918g/mol
  • Monoisotopic Mass: 211.0763918g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • Density: 1.153
  • Boiling Point: 357.6°C at 760 mmHg
  • Flash Point: 170°C
  • Refractive Index: 1.56

2-chloro-N-(4-methylphenyl)butanamide Pricemore >>

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