Cas no 13993-91-4 (Benzamide,3-[(dimethylamino)methyl]-2-methyl-N-phenyl-)

Benzamide,3-[(dimethylamino)methyl]-2-methyl-N-phenyl- structure
13993-91-4 structure
Product Name:Benzamide,3-[(dimethylamino)methyl]-2-methyl-N-phenyl-
CAS No:13993-91-4
MF:C17H20N2O
MW:268.353504180908
CID:193270
PubChem ID:264973
Update Time:2025-04-19

Benzamide,3-[(dimethylamino)methyl]-2-methyl-N-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Benzamide,3-[(dimethylamino)methyl]-2-methyl-N-phenyl-
    • (1Z)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)propan-2-one
    • 3-(Dimethylaminomethyl)-2-methyl-N-phenylbenzamid
    • CTK0E4020
    • Hexadecanoic acid, 3-(dimethylamino)propyl ester
    • DTXSID10930662
    • NSC100696
    • 13993-91-4
    • NSC-100696
    • 3-[(Dimethylamino)methyl]-2-methyl-N-phenylbenzene-1-carboximidic acid
    • Inchi: 1S/C17H20N2O/c1-13-14(12-19(2)3)8-7-11-16(13)17(20)18-15-9-5-4-6-10-15/h4-11H,12H2,1-3H3,(H,18,20)
    • InChI Key: ICASLLZNEVPCGV-UHFFFAOYSA-N
    • SMILES: O=C(C1=CC=CC(=C1C)CN(C)C)NC1C=CC=CC=1

Computed Properties

  • Exact Mass: 268.1577
  • Monoisotopic Mass: 268.158
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 310
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 32.3?2

Experimental Properties

  • Density: 1.112
  • Boiling Point: 340.7°Cat760mmHg
  • Flash Point: 159.9°C
  • Refractive Index: 1.609
  • PSA: 32.34
  • LogP: 3.38190
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