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Atomfair 3-[5-(methoxycarbonyl)-1H-pyrrol-2-yl]propanoic acid C9H11NO4 CAS 1041430-19-6

3-[5-(Methoxycarbonyl)-1H-pyrrol-2-yl]propanoic acid (CAS: 1041430-19-6) is a high-purity organic compound with the molecular formula C9H11NO4. This specialized chemical features a pyrrole ring substituted with a methoxycarbonyl group and a propanoic acid side chain, making it a valuable intermediate in synthetic organic chemistry and pharmaceutical research. With a molecular weight of 197.19 g/mol, it is supplied as a fine powder or crystalline solid, typically with ≥95% purity (HPLC). The compound is sensitive to light and moisture, requiring storage under inert conditions at 2-8°C. Its unique structure enables versatile applications in heterocyclic chemistry, particularly in the synthesis of bioactive molecules and functional materials.…

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Description

3-[5-(Methoxycarbonyl)-1H-pyrrol-2-yl]propanoic acid (CAS: 1041430-19-6) is a high-purity organic compound with the molecular formula C9H11NO4. This specialized chemical features a pyrrole ring substituted with a methoxycarbonyl group and a propanoic acid side chain, making it a valuable intermediate in synthetic organic chemistry and pharmaceutical research. With a molecular weight of 197.19 g/mol, it is supplied as a fine powder or crystalline solid, typically with ≥95% purity (HPLC). The compound is sensitive to light and moisture, requiring storage under inert conditions at 2-8°C. Its unique structure enables versatile applications in heterocyclic chemistry, particularly in the synthesis of bioactive molecules and functional materials. Researchers value this product for its consistent quality, batch-to-batch reproducibility, and suitability for demanding synthetic applications.

Properties

  • CAS Number: 1041430-19-6
  • Complexity: 229
  • IUPAC Name: 3-(5-methoxycarbonyl-1H-pyrrol-2-yl)propanoic acid
  • InChI: InChI=1S/C9H11NO4/c1-14-9(13)7-4-2-6(10-7)3-5-8(11)12/h2,4,10H,3,5H2,1H3,(H,11,12)
  • InChI Key: MKIXIQIJLIBXKS-UHFFFAOYSA-N
  • Exact Mass: 197.06880783
  • Molecular Formula: C9H11NO4
  • Molecular Weight: 197.19
  • SMILES: COC(=O)C1=CC=C(N1)CCC(=O)O
  • Topological: 79.4
  • Monoisotopic Mass: 197.06880783
  • Synonyms: 3-(5-(methoxycarbonyl)-1H-pyrrol-2-yl)propanoic acid, 1041430-19-6, 3-[5-(methoxycarbonyl)-1H-pyrrol-2-yl]propanoic acid, 839-716-0, 3-(5-methoxycarbonyl-1H-pyrrol-2-yl)propanoic acid, MFCD20660037, SCHEMBL1005267, MKIXIQIJLIBXKS-UHFFFAOYSA-N, RRB43019, AKOS027321405, SB62576, CS-16652, DB-356473, CS-0102076, D72083, EN300-1067087, 3-(5-(methoxycarbonyl)-1H-pyrrol-2-yl)propanoicacid, Z1262559007

Application

This compound serves as a key building block in the synthesis of pyrrole-containing pharmaceuticals and agrochemicals. Researchers utilize it in the development of potential protease inhibitors and antimicrobial agents due to its reactive carboxyl and ester functional groups. The molecule finds application in material science for creating functionalized polymers with tailored electronic properties. Its structural features make it valuable for studying charge transfer complexes in organic electronics.

Safety and Hazards

GHS Hazard Statements

  • H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]
  • H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
  • H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

  • P261, P264, P264+P265, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

  • Acute Tox. 5 (100%)
  • Skin Irrit. 2 (100%)
  • Eye Irrit. 2A (100%)
  • STOT SE 3 (100%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

Patent & Regulatory Compliance

Certain molecules may be protected by active patents or regulatory restrictions.

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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