(2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) | CAS No. 156604-79-4

(2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)

Basic Information

CAS Number

156604-79-4

Molecular Formula

C20H25NO6

Molecular Weight

375.42 g/mol

AD

Basic Physical Properties

Melting Point

104-106°C

Specific Rotation

+2 ~ +6° (c=1, EtOH)

CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)O.C(C(CO)(CO)N)O

InChI

InChI=1S/C16H14O3.C4H11NO3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;5-4(1-6,2-7)3-8/h2-11H,1H3,(H,18,19);6-8H,1-3,5H2/t11-;/m0./s1

InChIKey

QUZMDHVOUNDEKW-MERQFXBCSA-N

LogP

0.7664999999999991

Topological Polar Surface Area

141.08 Ų

Hydrogen Bond Donor/Acceptor

6 / 7

Complexity

385

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • Dexcetoprofeno trometamol
  • 2-amino-2-(hydroxymethyl)propane-1,3-diol;2-(3-benzoylphenyl)propanoic acid
  • AC-8135
  • J-009320
  • Dexketoprofen trometamol
  • DTXSID60935485
  • Dexketoprofene trometamolo
  • BCP09921
  • SCHEMBL8759161
  • SB48327
  • A883562
  • 2-(3-Benzoylphenyl)propanoic acid--2-amino-2-(hydroxymethyl)propane-1,3-diol (1/1)
  • 2-amino-2-(hydroxymethyl)-1,3-propanediol(s)-3-benzoyl-alpha-methylbenzeneacetate
  • (S)-Ketoprofen trometamol
  • Dexketoprofen trometamo
  • S-(+)-Ketoprofen trometamol
  • AKOS025402326
  • 156604-79-4
  • 2-Amino-2-(hydroxymethyl)propane-1,3-diol (S)-2-(3-benzoylphenyl)propanoate
  • 2-Amino-2-(hydroxymethyl)-1,3-propanediol (S)-3-benzoyl-alpha-methylbenzeneacetate
  • 2-amino-2-(hydroxymethyl)propane-1,3-diol,2-(3-benzoylphenyl)propanoic acid
  • (S)-3-Benzoyl-α-methylbenzeneacetic acid compound with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)
  • (S)-Ketoprofen tromethamol
  • Dexketoprofen tromethamine salt
  • L-Ketoprofen trometamol
  • D-ketoprofen troMethaMine
  • Dexketoprofen TroMetaMol API
  • (S)-(+)-Form tromethamine salt
  • Dexketoprofen Trometamol Tablets
  • (S)-Ketoprofen Tromethamine Salt (Dexketoprofen Trometamol)
  • (S)-2-(3-benzoylphenyl)propanoic acid

MDL Number

MFCD00947638

Customs Code

2922199090

FAQ

What regulatory guidelines apply to (2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) (CAS: 156604-79-4)?

This compound is subject to REACH regulations in the European Union, which require registration based on its tonnage and potential risk. It also falls under the GHS system, with specific hazard classification requirements. For FDA and EPA purposes, it may be regulated under the Toxic Substances Control Act (TSCA) and other environmental laws, depending on its intended use and properties.

Are there alternatives to (2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) (CAS: 156604-79-4) in synthesis?

Alternatives include using isomers or analogs such as (2R)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) or other similar compounds. Common alternative reagents might include different benzoyl derivatives or amino acids, depending on the desired properties of the final product.

What is the market or research trend for (2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) (CAS: 156604-79-4)?

Research trends indicate increasing interest in the compound for its potential in pharmaceutical and biotechnological applications. Market trends show growing demand driven by its use in developing novel drug candidates and as a key intermediate in various synthetic pathways. However, market dynamics are influenced by regulatory changes and cost fluctuations.

How should waste containing (2S)-2-(3-Benzoylphenyl)propanoic acid - 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1) (CAS: 156604-79-4) be handled?

Waste should be collected in sealed containers and disposed of in accordance with local and national hazardous waste regulations. Incineration or professional waste disposal services are recommended. Environmental protection precautions include proper containment to prevent spills and ensure safe transport. Always follow safety guidelines and consult relevant environmental protection authorities for specific disposal procedures.

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