Cas no 1114595-63-9 (Methyl (3-oxopyrazolidin-4-yl)acetate)

Methyl (3-oxopyrazolidin-4-yl)acetate structure
1114595-63-9 structure
Product Name:Methyl (3-oxopyrazolidin-4-yl)acetate
CAS No:1114595-63-9
MF:C6H10N2O3
MW:158.155201435089
MDL:MFCD13817362
CID:4680276
Update Time:2023-08-14

Methyl (3-oxopyrazolidin-4-yl)acetate Chemical and Physical Properties

Names and Identifiers

    • methyl (3-oxopyrazolidin-4-yl)acetate
    • methyl 2-(3-oxopyrazolidin-4-yl)acetate
    • STL198010
    • SBB083225
    • FCH924397
    • T3527
    • 4-pyrazolidineacetic acid, 3-oxo-, methyl ester
    • methyl 2-(3-oxotetrahydro-1H-pyrazol-4-yl)acetate
    • Methyl (3-oxopyrazolidin-4-yl)acetate
    • MDL: MFCD13817362
    • Inchi: 1S/C6H10N2O3/c1-11-5(9)2-4-3-7-8-6(4)10/h4,7H,2-3H2,1H3,(H,8,10)
    • InChI Key: NKBSEDDDYBSGGT-UHFFFAOYSA-N
    • SMILES: O=C1C(CC(=O)OC)CNN1

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 181
  • Topological Polar Surface Area: 67.4

Methyl (3-oxopyrazolidin-4-yl)acetate Pricemore >>

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