Cas no 25031-06-5 (Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride)

Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride structure
25031-06-5 structure
Product Name:Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride
CAS No:25031-06-5
MF:C14H23ClN2O5S
MW:366.860821962357
CID:282310
Update Time:2025-10-28

Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-amino-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester,monohydrochloride, [2S-(2a,5a,6b)]- (9CI)
    • Pivaloyloxymethyl (2S-(2alpha,5alpha,6beta))-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate monohydrochloride
    • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-amino-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester,mono
    • 2,2-Dimethylpropanoyloxymethyl (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hepta
    • Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride
    • Inchi: 1S/C14H22N2O5S.ClH/c1-13(2,3)12(19)21-6-20-11(18)8-14(4,5)22-10-7(15)9(17)16(8)10;/h7-8,10H,6,15H2,1-5H3;1H/t7-,8+,10-;/m1./s1
    • InChI Key: CWYYGKKFQLPVMI-JUHCGIOYSA-N
    • SMILES: Cl.S1C(C)(C)[C@H](C(=O)OCOC(C(C)(C)C)=O)N2C([C@H]([C@@H]12)N)=O

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 6
  • Complexity: 514
  • Topological Polar Surface Area: 124

Pivaloyloxymethyl 6-Aminopenicillanate Hydrochloride Pricemore >>

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