Cas no 871727-77-4 ((2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid)

(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid structure
871727-77-4 structure
Product Name:(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid
CAS No:871727-77-4
MF:C11H19NO4
MW:229.27286362648
MDL:MFCD07784044
CID:719353
PubChem ID:26599272
Update Time:2024-12-09

(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • (2R,4R)-1-(tert-Butoxycarbonyl)-4-methylpyrrolidine-2-carboxylic acid
    • (2R,4R)-1-Boc-4-methylpyrrolidine-2-carboxylic acid
    • (4R)-1-Boc-4-Methyl-D-proline
    • 1,2-Pyrrolidinedicarboxylicacid, 4-methyl-, 1-(1,1-dimethylethyl) ester, (2R,4R)-
    • (2R,4R)-4-Methyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester
    • (2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid
    • 1-(1,1-Dimethylethyl) (2R,4R)-4-methyl-1,2-pyrrolidinedicarboxylate (ACI)
    • DTXSID80650264
    • WJB72777
    • CS-0054809
    • (2R,4R)-1-(tert-Butoxycarbonyl)-4-methylpyrrolidine-2-carboxylicacid
    • 871727-77-4
    • SCHEMBL8214873
    • AKOS016844369
    • AS-36763
    • MFCD07784044
    • (2R,4R)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
    • (4R)-1-(tert-Butoxycarbonyl)-4-methyl-D-proline
    • EN300-22888795
    • rac-(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid
    • MDL: MFCD07784044
    • Inchi: 1S/C11H19NO4/c1-7-5-8(9(13)14)12(6-7)10(15)16-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,14)/t7-,8-/m1/s1
    • InChI Key: MXKSXPYZNXUHEZ-HTQZYQBOSA-N
    • SMILES: C(N1C[C@H](C)C[C@@H]1C(=O)O)(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 229.13100
  • Monoisotopic Mass: 229.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 295
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 66.8A^2
  • XLogP3: 1.7

Experimental Properties

  • Color/Form: Pale-yellow to Yellow-brown Solid
  • Density: 1.15
  • Boiling Point: 343.2°C at 760 mmHg
  • Flash Point: 161.4°C
  • Refractive Index: 1.49
  • PSA: 66.84000
  • LogP: 1.65440

(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid Security Information

(2R,4R)-1-[(tert-butoxy)carbonyl]-4-methylpyrrolidine-2-carboxylic acid Pricemore >>

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