Cas no 569660-89-5 ((S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate)

(S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate structure
569660-89-5 structure
Product Name:(S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate
CAS No:569660-89-5
MF:C9H16BrNO2
MW:250.132842063904
MDL:MFCD17214728
CID:822033
PubChem ID:34179480
Update Time:2025-04-19

(S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • (S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate
    • (S)-(+)-1-Boc-3-bromopyrrolidine
    • (S)-3-Bromo-pyrrolidine-1-carboxylic acid tert-butyl ester
    • 1-Pyrrolidinecarboxylic acid, 3-bromo-, 1,1-dimethylethyl ester, (3S)-
    • AS-47290
    • DTXSID40653094
    • tert-Butyl (3S)-3-bromopyrrolidine-1-carboxylate
    • 1-Boc-(S)-3-bromopyrrolidine
    • 569660-89-5
    • F13112
    • EN300-1663561
    • (S)-tert-Butyl3-bromopyrrolidine-1-carboxylate
    • DA-17304
    • MFCD17214728
    • SCHEMBL4343895
    • QJTKPXFJOXKUEY-ZETCQYMHSA-N
    • AKOS015906886
    • MDL： MFCD17214728
    • Inchi： 1S/C9H16BrNO2/c1-9(2,3)13-8(12)11-5-4-7(10)6-11/h7H,4-6H2,1-3H3/t7-/m0/s1
    • InChI Key： QJTKPXFJOXKUEY-ZETCQYMHSA-N
    • SMILES： Br[C@@H]1CN(C(=O)OC(C)(C)C)CC1

Computed Properties

  • Exact Mass: 249.03648
  • Monoisotopic Mass: 249.03644g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 200
  • 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: 2.1
  • Topological Polar Surface Area: 29.5?2

Experimental Properties

  • Density: 1.379
  • Boiling Point: 278 oC
  • Flash Point: 122 oC
  • PSA: 29.54

(S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate Security Information

  • HazardClass：9

(S)-tert-Butyl 3-bromopyrrolidine-1-carboxylate Pricemore >>

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