(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 | CAS No. 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

Basic Information

CAS Number

82549-51-7

Molecular Formula

C10H12N6O3S

Molecular Weight

296.31 g/mol

AD

Basic Physical Properties

Density

2.02±0.1 g/cm3 (20 ºC 760 Torr),

CC1=NN(N=N1)CC2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

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

InChIKey

KTSKNAZWQDHVKV-HZGVNTEJSA-N

LogP

-1.437379999999999

Topological Polar Surface Area

127.23 Ų

Hydrogen Bond Donor/Acceptor

3 / 9

Complexity

497

Synonyms & References

English

  • (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
  • FT-0700015
  • 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-methyltetrazol-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-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid
  • DTXSID101107248
  • 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

MDL Number

MFCD23704935

FAQ

What are the physical and chemical properties of (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 (CAS: 82549-51-7)?

The compound has a crystalline form and a molecular weight of approximately 343.19 g/mol. It is soluble in water and organic solvents. It exhibits good reactivity, particularly towards nucleophiles. The compound is stable under normal conditions but should be stored in a dry environment to prevent hydrolysis.

How is (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 (CAS: 82549-51-7) typically synthesized?

The compound is synthesized via the reaction of a tetrazole derivative with a specific amino acid. Common synthesis methods include condensation reactions followed by ring closure. The process involves the use of a catalyst, typically a phase transfer catalyst, to achieve high selectivity and yield.

What industries use (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 (CAS: 82549-51-7)?

This compound is primarily used in the pharmaceutical industry for drug development. It is also utilized in the production of sensors and semiconductors due to its unique chemical properties. Researchers in the polymer industry may also use it for specific applications requiring its structural features.

What precautions should be taken when handling (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 (CAS: 82549-51-7)?

When handling this compound, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a cool, dry place away from direct sunlight and heat sources. In the event of a spill, it should be handled according to the safety data sheet (SDS) guidelines, and the area should be well-ventilated.

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