Cas no 115880-49-4 (ethyl (3R)-3-aminobutanoate)

ethyl (3R)-3-aminobutanoate structure
ethyl (3R)-3-aminobutanoate structure
Product Name:ethyl (3R)-3-aminobutanoate
CAS No:115880-49-4
MF:C6H13NO2
MW:131.172921895981
MDL:MFCD06797564
CID:130967
PubChem ID:10855488
Update Time:2024-02-29

ethyl (3R)-3-aminobutanoate Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,3-amino-, ethyl ester, (3R)-
    • (R)-ETHYL-3-AMINOBUTYRATE
    • (R)-3-Aminobutyricacidethylester
    • (S)-3-AMINO-BUTYRIC ACID ETHYL ESTER
    • ethyl 3-aminobutanoate
    • (R)-3-Aminobutanoic acid ethyl ester
    • (R)-ethyl 3-aminobutanoate
    • (3R)-3-Aminobutanoic acid ethyl ester
    • AKOS006277974
    • EN300-862809
    • H11544
    • SCHEMBL7405660
    • GS-5541
    • (r)-ethyl3-aminobutanoate
    • (R)-3-Aminobutyric acid ethyl ester
    • Butanoic acid, 3-amino-, ethyl ester, (3R)-
    • MFCD06797564
    • 115880-49-4
    • ETHYL (3R)-3-AMINOBUTANOATE
    • ethyl (3R)-3-aminobutanoate
    • MDL: MFCD06797564
    • Inchi: 1S/C6H13NO2/c1-3-9-6(8)4-5(2)7/h5H,3-4,7H2,1-2H3/t5-/m1/s1
    • InChI Key: HHIOOBJZIASBFF-RXMQYKEDSA-N
    • SMILES: O(CC)C(C[C@@H](C)N)=O

Computed Properties

  • Exact Mass: 131.09500
  • Monoisotopic Mass: 131.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 93.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.1
  • Topological Polar Surface Area: 52.3?2

Experimental Properties

  • Density: 0.970
  • Boiling Point: 169 oC
  • Flash Point: 42 oC
  • PSA: 52.32000
  • LogP: 0.98710

ethyl (3R)-3-aminobutanoate Pricemore >>

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