Cas no 886497-64-9 (Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate)

Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate structure
886497-64-9 structure
Product Name:Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate
CAS No:886497-64-9
MF:C11H18N2O2S
MW:242.337821483612
MDL:MFCD06739366
CID:3031241
PubChem ID:7174207
Update Time:2025-04-21

Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 2-BUTYLAMINO-4-METHYL-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
    • MFCD06739366
    • BBL040451
    • Ethyl 2-(butylamino)-4-methylthiazole-5-carboxylate
    • LS-10898
    • EN300-230414
    • 886497-64-9
    • Ethyl2-(butylamino)-4-methylthiazole-5-carboxylate
    • AKOS000313000
    • Ethyl 2-(butylamino)-4-methyl-5-thiazolecarboxylate
    • ethyl 2-(butylamino)-4-methyl-1,3-thiazole-5-carboxylate
    • STK350484
    • Ethyl 2-(butylimino)-4-methyl-2,3-dihydrothiazole-5-carboxylate
    • DTXSID401223784
    • ALBB-030520
    • CS-0297668
    • Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate
    • MDL: MFCD06739366
    • Inchi: 1S/C11H18N2O2S/c1-4-6-7-12-11-13-8(3)9(16-11)10(14)15-5-2/h4-7H2,1-3H3,(H,12,13)
    • InChI Key: DTTJRKCVQMPVFF-UHFFFAOYSA-N
    • SMILES: S1C(C(=O)OCC)=C(C)N=C1NCCCC

Computed Properties

  • Exact Mass: 242.10889899Da
  • Monoisotopic Mass: 242.10889899Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 226
  • 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: 3.5
  • Topological Polar Surface Area: 79.5?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Melting Point: NA
  • Boiling Point: 335.9±34.0 °C at 760 mmHg
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C

Ethyl 2-(Butylamino)-4-methyl-1,3-thiazole-5-carboxylate Security Information

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