Cas no 859213-51-7 ((S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine)

(S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine structure
859213-51-7 structure
Product Name:(S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine
CAS No:859213-51-7
MF:C12H24N2O2
MW:228.331163406372
MDL:MFCD08275942
CID:69047
PubChem ID:24820459
Update Time:2024-10-26

(S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine Chemical and Physical Properties

Names and Identifiers

    • (S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine
    • (S)-1-tert-Butoxycarbonyl-3-((dimethylamino)methyl)pyrrolidine
    • (S)-tert-Butyl 3-((dimethylamino)methyl)pyrrolidine-1-carboxylate
    • tert-butyl (3S)-3-[(dimethylamino)methyl]pyrrolidine-1-carboxylate
    • (S)-1-(t-butoxycarbonyl)-3-(dimethylaminomethyl)pyrrolidine
    • AC-1791
    • J-502539
    • AMY32651
    • (S)-tert-butyl3-((dimethylamino)methyl)pyrrolidine-1-carboxylate
    • DTXSID80647518
    • SCHEMBL3564630
    • 85916-26-3
    • AKOS015836448
    • A841495
    • (S)-1-N-Boc-3-[(Dimethylamino)methyl]pyrrolidine
    • 859213-51-7
    • (3S)-3-[(dimethylamino)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester
    • MDL： MFCD08275942
    • Inchi： 1S/C12H24N2O2/c1-12(2,3)16-11(15)14-7-6-10(9-14)8-13(4)5/h10H,6-9H2,1-5H3/t10-/m0/s1
    • InChI Key： SVFCKPUIJBZBQS-JTQLQIEISA-N
    • SMILES： O(C(C)(C)C)C(N1CC[C@@H](CN(C)C)C1)=O

Computed Properties

  • Exact Mass: 228.18400
  • Monoisotopic Mass: 228.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 246
  • 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
  • Topological Polar Surface Area: 32.8A^2
  • XLogP3: 1.5

Experimental Properties

  • Density: 1
  • Boiling Point: 285.6°C at 760 mmHg
  • Flash Point: 126.5°C
  • Refractive Index: 1.477
  • PSA: 32.78000
  • LogP: 1.74290

(S)-1-Boc-3-((Dimethylamino)methyl)pyrrolidine Pricemore >>

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