Cas no 299920-47-1 (1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid)

1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid structure
299920-47-1 structure
Product Name:1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid
CAS No:299920-47-1
MF:C8H13NO3
MW:171.193722486496
MDL:MFCD02110460
CID:249372
PubChem ID:3151004
Update Time:2025-04-19

1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid
    • 1-Isopropyl-2-oxopyrrolidine-4-carboxylic Acid
    • 1-Isopropyl-5-oxo-pyrrolidine-3-carboxylic acid
    • 3-Pyrrolidinecarboxylicacid, 1-(1-methylethyl)-5-oxo-
    • 1-(methylethyl)-5-oxopyrrolidine-3-carboxylic acid
    • 1-isopropyl-5-oxopyrrolidine-3-carboxylic acid(SALTDATA: FREE)
    • 5-oxo-1-(propan-2-yl)pyrrolidine-3-carboxylic acid
    • AC1MK65O
    • AC1Q1Q2M
    • ChemDiv2_002218
    • 3-Pyrrolidinecarboxylic acid, 1-(1-methylethyl)-5-oxo-
    • 1-isopropyl-5-oxo-3-pyrrolidinecarboxylic acid
    • 5-oxo-1-propan-2-ylpyrrolidine-3-carboxylic acid
    • 1-isopropyl-5-oxopyrrolidine-3-carboxylicacid
    • MLS000124070
    • CHE
    • AS-871/40439622
    • EN300-33398
    • FT-0691117
    • CHEMBL1410467
    • SMR000124615
    • BB 0219704
    • MFCD02110460
    • SR-01000529552
    • AKOS016040511
    • 1-isopropyl-5-oxopyrrolidine-3-carboxylic acid;1-Isopropyl-2-oxopyrrolidine-4-carboxylic Acid
    • SY012397
    • 299920-47-1
    • Z57324871
    • HMS1375E18
    • AS-31709
    • SCHEMBL2164818
    • SR-01000529552-1
    • 1-Isopropyl-2-oxopyrrolidine-4-carboxylicAcid
    • EU-0052483
    • 1-isopropyl-5-oxo-pyrrolidine-3-carboxylic acid, AldrichCPR
    • DTXSID40389947
    • A5545
    • AKOS000139933
    • HMS2473E14
    • BBL008653
    • ALBB-008679
    • STK026126
    • MDL: MFCD02110460
    • Inchi: 1S/C8H13NO3/c1-5(2)9-4-6(8(11)12)3-7(9)10/h5-6H,3-4H2,1-2H3,(H,11,12)
    • InChI Key: YKWIPHFVESIOGN-UHFFFAOYSA-N
    • SMILES: O=C1CC(C(=O)O)CN1C(C)C

Computed Properties

  • Exact Mass: 171.08959
  • Monoisotopic Mass: 171.08954328g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 212
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.2
  • Topological Polar Surface Area: 57.6

Experimental Properties

  • Boiling Point: 358.3℃ at 760 mmHg
  • Flash Point: 170.5℃
  • PSA: 57.61

1-Isopropyl-5-oxopyrrolidine-3-carboxylic acid Pricemore >>

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