Cas no 97519-40-9 ((E)-Ceftibuten Dihydrate)

(E)-Ceftibuten Dihydrate structure
(E)-Ceftibuten Dihydrate structure
Product Name:(E)-Ceftibuten Dihydrate
CAS No:97519-40-9
MF:C15H14N4O6S2
MW:410.424860477448
CID:1064084
PubChem ID:6398762
Update Time:2025-04-20

(E)-Ceftibuten Dihydrate Chemical and Physical Properties

Names and Identifiers

    • (E)-Ceftibuten Dihydrate
    • (6R,7R)-7-{[(2E)-2-(2-Amino-1,3-thiazol-4-yl)-4-carboxy-2-butenoy l]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic a cid
    • trans-Ceftibuten
    • (6R,7R)-7-((E)-2-(2-Aminothiazol-4-yl)-4-carboxybut-2-enamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • (6R,7R)-7-[[(2E)-2-(2-Amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • (6R,7R)-7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxy-but-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • 1428117-81-0
    • 4DS5YK8DR8
    • BIDD:GT0855
    • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-butenyl]amino]-8-oxo-, [6R-[6alpha,7beta(E)]]-
    • (6R,7R)-7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • DTXSID701101600
    • SCHEMBL37055
    • SCHEMBL9512124
    • 97519-40-9
    • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2E)-2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-, (6R,7R)-
    • 97519-39-6
    • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2E)-2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-butenyl]amino]-8-oxo-, (6R,7R)-
    • Inchi： 1S/C15H14N4O6S2/c16-15-17-7(5-27-15)6(1-2-9(20)21)11(22)18-10-12(23)19-8(14(24)25)3-4-26-13(10)19/h1,3,5,10,13H,2,4H2,(H2,16,17)(H,18,22)(H,20,21)(H,24,25)/b6-1+/t10-,13-/m1/s1
    • InChI Key： UNJFKXSSGBWRBZ-VTSZRNMSSA-N
    • SMILES： S1CC=C(C(=O)O)N2C([C@H]([C@@H]12)NC(/C(=C/CC(=O)O)/C1=CSC(N)=N1)=O)=O

Computed Properties

  • Exact Mass: 410.035476
  • Monoisotopic Mass: 410.035476
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 6
  • Complexity: 755
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 217
  • XLogP3: -0.3

Experimental Properties

  • Density: 1.75
  • Boiling Point: 966.4°C at 760 mmHg
  • Flash Point: 538.3°C
  • Refractive Index: 1.762
  • PSA: 220.68000
  • LogP: 0.66010

(E)-Ceftibuten Dihydrate Related Literature

97519-40-9 ((E)-Ceftibuten Dihydrate) Related Products

Recommended suppliers
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.
Changzhou Guanjia Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Changzhou Guanjia Chemical Co., Ltd
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing jingzhu bio-technology Co., Ltd.