Cas no 62524-21-4 (3-Chloro-1-benzothiophene-2-carbohydrazide)

3-Chloro-1-benzothiophene-2-carbohydrazide is a heterocyclic compound featuring a benzothiophene core substituted with a chloro group at the 3-position and a carbohydrazide moiety at the 2-position. This structure imparts reactivity suitable for applications in medicinal chemistry and organic synthesis, particularly as a versatile intermediate for the development of pharmacologically active molecules. The chloro group enhances electrophilic reactivity, facilitating further functionalization, while the carbohydrazide moiety offers opportunities for condensation reactions, enabling the formation of hydrazones and other derivatives. Its well-defined molecular framework makes it valuable for constructing complex heterocyclic systems, contributing to research in drug discovery and material science.
3-Chloro-1-benzothiophene-2-carbohydrazide structure
62524-21-4 structure
Product Name:3-Chloro-1-benzothiophene-2-carbohydrazide
CAS No:62524-21-4
MF:C9H7ClN2OS
MW:226.682679414749
MDL:MFCD00052502
CID:520223
PubChem ID:606925
Update Time:2025-11-02

3-Chloro-1-benzothiophene-2-carbohydrazide Chemical and Physical Properties

Names and Identifiers

    • 3-Chlorobenzo[b]thiophene-2-carbohydrazide
    • 3-Chloro-1-benzothiophene-2-carbohydrazide
    • Benzo[b]thiophene-2-carboxylicacid, 3-chloro-, hydrazide
    • 3-chloro-2-hydrazinocarbonylbenzo<b>thiophene
    • BDBM163694
    • CHEMBL4436904
    • CCG-235148
    • G29049
    • STK070860
    • 3-CHLOrobenZO[B]THIOPHENE-2-CARBOXYLIC ACID HYDRAZIDE
    • BBL013900
    • VS-04037
    • AKOS000116258
    • 3-chlorobenzo(b)thiophene 2-carboxylic acid hydrazide
    • 62524-21-4
    • 3-Chloro-1-benzothiophene-2-carbohydrazide #
    • 3-chloro-benzo[b]thiophene-2-carboxylic acidhydrazide
    • 3‐Chloro‐1‐benzothiophene‐2‐carbohydrazide (O8-Cl)
    • BP-11989
    • MFCD00052502
    • NS00097805
    • CS-0219309
    • UPCMLD0ENAT0515-0157:001
    • EN300-03673
    • 3-chlorobenzo[b]thiophene-carboxylic acid hydrazide
    • J-512312
    • DTXSID80345764
    • 3-Chloro-benzo[b]thiophene-2-carboxylic acid hydrazide
    • HMS542O22
    • DTXCID70296837
    • DB-026070
    • Z56896259
    • Benzo[b]thiophene-2-carbohydrazide, 3-chloro-
    • ALBB-002495
    • SCHEMBL6477287
    • Maybridge1_000506
    • MDL: MFCD00052502
    • Inchi: 1S/C9H7ClN2OS/c10-7-5-3-1-2-4-6(5)14-8(7)9(13)12-11/h1-4H,11H2,(H,12,13)
    • InChI Key: HSEDHPBSCKIDQU-UHFFFAOYSA-N
    • SMILES: ClC1=C(C(NN)=O)SC2C=CC=CC=21

Computed Properties

  • Exact Mass: 225.99700
  • Monoisotopic Mass: 225.9967617g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 239
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 83.4?2

Experimental Properties

  • Melting Point: 181 °C
  • PSA: 83.36000
  • LogP: 3.24940

3-Chloro-1-benzothiophene-2-carbohydrazide Security Information

  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S37/39
  • Hazardous Material Identification: Xi
  • Safety Term:S26;S37/39
  • HazardClass:IRRITANT
  • Risk Phrases:R36/37/38

3-Chloro-1-benzothiophene-2-carbohydrazide Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Additional information on 3-Chloro-1-benzothiophene-2-carbohydrazide

3-Chloro-1-benzothiophene-2-carbohydrazide (CAS No. 62524-21-4): A Versatile Chemical Intermediate for Modern Applications

3-Chloro-1-benzothiophene-2-carbohydrazide (CAS No. 62524-21-4) is a specialized organic compound that has garnered significant attention in pharmaceutical and material science research. This benzothiophene derivative features a unique molecular structure combining a chloro-substituted benzothiophene core with a reactive carbohydrazide functional group, making it valuable for synthesizing complex molecules. Researchers frequently search for "3-Chloro-1-benzothiophene-2-carbohydrazide uses" and "CAS 62524-21-4 suppliers," reflecting its growing importance in drug discovery.

The compound's molecular formula C9H7ClN2OS and molecular weight 226.68 g/mol position it as a crucial intermediate in medicinal chemistry. Recent studies highlight its role in developing kinase inhibitors, a hot topic in cancer research, as evidenced by searches for "benzothiophene-based drug candidates 2024." Its chloro group offers excellent reactivity for cross-coupling reactions, while the hydrazide moiety enables condensation reactions—key features that organic chemists explore when searching "how to modify benzothiophene carbohydrazide."

In material science, 3-Chloro-1-benzothiophene-2-carbohydrazide contributes to developing organic semiconductors and photovoltaic materials, aligning with the booming interest in "sustainable electronic materials." The compound's extended π-conjugation system makes it valuable for designing OLED components, responding to frequent queries about "benzothiophene derivatives for optoelectronics." Analytical chemists also utilize it as a chromogenic reagent for metal ion detection, addressing laboratory needs reflected in searches for "selective chemical sensors."

The global market for benzothiophene derivatives shows consistent growth, with 3-Chloro-1-benzothiophene-2-carbohydrazide maintaining steady demand among pharmaceutical intermediates suppliers. Industry reports tracking "specialty chemicals market trends 2024" highlight its relevance. Proper handling requires standard laboratory precautions—users often seek "3-Chloro-1-benzothiophene-2-carbohydrazide safety data" and "storage conditions for heterocyclic carbohydrazides," emphasizing the need for technical documentation.

Recent patent literature reveals innovative applications of CAS 62524-21-4 in developing antimicrobial agents, particularly against drug-resistant strains—a pressing concern reflected in searches for "new antibiotic scaffolds." Its structural features enable researchers to create bioactive molecular hybrids, answering frequent queries about "multifunctional heterocyclic compounds." The compound's crystallographic properties also interest materials scientists investigating "molecular packing in organic crystals."

Quality specifications for 3-Chloro-1-benzothiophene-2-carbohydrazide typically require ≥98% purity, with advanced analytical techniques like HPLC-MS ensuring batch consistency—details often sought under "analytical methods for benzothiophene derivatives." The compound's solubility profile (soluble in DMSO, DMF; sparingly soluble in ethanol) makes it versatile for various reaction conditions, addressing practical questions about "handling chloro-substituted heterocycles."

Environmental considerations drive research into green synthesis routes for 3-Chloro-1-benzothiophene-2-carbohydrazide, matching industry searches for "sustainable heterocycle production." Computational chemistry studies predict its electronic properties and reactivity patterns, resources frequently accessed under "DFT studies on benzothiophene derivatives." These multidimensional applications ensure its continued relevance across scientific disciplines.

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