Cas no 82549-51-7 ((6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid)

(6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid structure
82549-51-7 structure
Product Name:(6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid
CAS No:82549-51-7
MF:C10H12N6O3S
MW:296.305679321289
CID:884321
PubChem ID:13064717
Update Time:2025-04-19

(6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • (6R,7R)-7-Amino-3-((5-methyl-2H-tetrazol-2-yl)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • Parent nucleus of CefteraM(7-MTA)
    • (6R,7R)-7-Amino-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thi a-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • 7-MTA
    • (6R,7R)-7-Amino-3-((5-methyl-2H-tetrazol-2-yl)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid
    • FT-0700015
    • (6R,7R)-7-amino-3-[(5-methyltetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • DTXSID101107248
    • 82549-51-7
    • (6R,7R)-7-Amino-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    • (6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid
    • Inchi: 1S/C10H12N6O3S/c1-4-12-14-15(13-4)2-5-3-20-9-6(11)8(17)16(9)7(5)10(18)19/h6,9H,2-3,11H2,1H3,(H,18,19)/t6-,9-/m1/s1
    • InChI Key: KTSKNAZWQDHVKV-HZGVNTEJSA-N
    • SMILES: S1CC(CN2N=NC(C)=N2)=C(C(=O)O)N2C([C@H]([C@@H]12)N)=O

Computed Properties

  • Exact Mass: 296.06915944g/mol
  • Monoisotopic Mass: 296.06915944g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 497
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.4
  • Topological Polar Surface Area: 153?2

Experimental Properties

  • Density: 2.02±0.1 g/cm3 (20 oC 760 Torr),
  • Solubility: Slightly soluble (1.8 g/l) (25 o C),

(6R,7R)-7-Amino-3-(5-methyl-2H-tetrazol-2-yl)methyl-8-oxo-5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic Acid Pricemore >>

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