Cas no 21759-70-6 (2-Butenoic acid, 3-(methylamino)-, ethyl ester, (2Z)-)

2-Butenoic acid, 3-(methylamino)-, ethyl ester, (2Z)- structure
21759-70-6 structure
Product Name:2-Butenoic acid, 3-(methylamino)-, ethyl ester, (2Z)-
CAS No:21759-70-6
MF:C7H13NO2
MW:143.183622121811
CID:1404039
PubChem ID:6112842
Update Time:2025-04-20

2-Butenoic acid, 3-(methylamino)-, ethyl ester, (2Z)- Chemical and Physical Properties

Names and Identifiers

    • 2-Butenoic acid, 3-(methylamino)-, ethyl ester, (2Z)-
    • ethyl-3-aminomethyl crotonate
    • ethyl beta-N-methylaminocrotonate
    • ETHYL 3-METHYLAMINOCROTONATE
    • 3-Methyl-3-(N-methyl)amino-acrylic acid ethyl ester
    • ethyl (Z)-3-(methylamino)but-2-enoate
    • 870-85-9
    • SCHEMBL6570866
    • AKOS005267210
    • (Z)-3-methylamino-but-2-enoic acid ethyl ester
    • MFCD03060877
    • 21759-70-6
    • MDL: MFCD03060877
    • Inchi: 1S/C7H13NO2/c1-4-10-7(9)5-6(2)8-3/h5,8H,4H2,1-3H3/b6-5-
    • InChI Key: FARYTWBWLZAXNK-WAYWQWQTSA-N
    • SMILES: O(C(/C=C(/C)\NC)=O)CC

Computed Properties

  • Exact Mass: 143.09469
  • Monoisotopic Mass: 143.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 141
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 38.3?2

Experimental Properties

  • PSA: 38.33

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