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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS No. 29457-07-6

Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Basic Information

Chemical_Structure_Of
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CAS Number

29457-07-6

Molecular Formula

C15H14N2Na2O6S2

Molecular Weight

428.4 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

768.3°C at 760 mmHg

Flash Point

418.4°C

SMILES

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CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CSC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]

InChI

InChI=1S/C15H16N2O6S2.2Na/c1-15(2)9(14(22)23)17-11(19)8(12(17)25-15)16-10(18)7(13(20)21)6-3-4-24-5-6;;/h3-5,7-9,12H,1-2H3,(H,16,18)(H,20,21)(H,22,23);;/q;2*+1/p-2/t7-,8-,9+,12-;;/m1../s1

InChIKey

ZBBCUBMBMZNEME-QBGWIPKPSA-L

LogP

-1.79260

Complexity

629

Synonyms & References

English

  • EINECS 249-642-5
  • Ticarcillin disodium (USP)
  • BRL 2288
  • TICARCILLIN DISODIUM COMPONENT OF TIMENTIN
  • A827122
  • Ticarcillin disodium salt
  • G8TVV6DSYG
  • Ticar (TN)
  • CAS-4697-14-7
  • sodium (2S,5R,6R)-6-((R)-2-carboxylato-2-(thiophen-3-yl)acetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-thiophen-3-ylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • UNII-G8TVV6DSYG
  • (2S,5R,6R)-6-[[(2R)-3-hydroxy-3-oxo-2-(3-thienyl)propanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
  • NCGC00017046-01
  • F18001
  • 29457-07-6
  • Disodium, Ticarcillin
  • 4697-14-7
  • Ticar
  • A822398
  • disodium (2S,5R,6R)-3,3-dimethyl-6-[[(2R)-3-oxidanidyl-3-oxidanylidene-2-thiophen-3-yl-propanoyl]amino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • Ticarcillin Disodium Salt (Contain 10% Methanol)
  • MFCD07787410
  • disodium;(2S,5R,6R)-6-[[(2R)-2-carboxylato-2-thiophen-3-ylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • Ticarpen
  • TICARCILLIN SODIUM [MART.]
  • ticarcillin sodium
  • CHEBI:35017
  • disodium (2S,5R,6R)-6-(((2R)-2-carboxylato-2-thiophen-3-ylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate
  • TICARCILLIN DISODIUM [USP MONOGRAPH]
  • TICARCILLIN SODIUM (MART.)

MDL Number

MFCD07787410

FAQ

What are the physical and chemical properties of Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (CAS: 29457-07-6)?
Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate is a crystalline compound with a molecular weight of approximately 558.4 g/mol. It is poorly soluble in water but soluble in organic solvents. The compound has moderate reactivity, particularly towards bases and reducing agents. It is stable under normal conditions but should be stored in a dry environment to prevent hydrolysis.

How is Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (CAS: 29457-07-6) typically synthesized?
Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate is typically synthesized via a multi-step procedure involving the condensation of thienyl acetic acid with an amino compound, followed by derivatization and sodium salt formation. The reaction is performed under mild conditions using catalysts like triethylamine to enhance selectivity and yield.

What industries use Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (CAS: 29457-07-6)?
Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate is primarily used in the pharmaceutical industry for its potential as a drug intermediate. It may also find applications in the polymer industry for developing new materials and in the sensor technology sector for its chemical reactivity.

What precautions should be taken when handling Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (CAS: 29457-07-6)?
When handling Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, it is crucial to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Work should be performed in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using appropriate absorbents, and the area should be thoroughly rinsed with water. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions.

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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate — ShangHaiChuangSai Technology Co Ltd

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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate — Shanghai Yuyeh Biotechnology Co., Ltd.

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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate — ShenZhenAiTaHuaXue Co Ltd

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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate — Shanghai Jixiang Biotechnology Co., Ltd.

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Disodium (2S,5R,6R)-6-{[(2R)-2-carboxylato-2-(3-thienyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate — JiangSuAiKangShengWuYiYaoYanFa Co Ltd

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