Cas no 86620-70-4 (4-(Piperazinomethyl)benzoic Acid, Dihydrochloride)

4-(Piperazinomethyl)benzoic Acid Dihydrochloride is a versatile organic compound widely used in pharmaceutical and chemical research. Its piperazine moiety enhances solubility and bioavailability, making it valuable for drug development, particularly in the synthesis of bioactive molecules and receptor-targeting agents. The dihydrochloride salt form improves stability and handling, ensuring consistent performance in reactions. This compound serves as a key intermediate in the preparation of heterocyclic compounds and potential therapeutic agents. Its well-defined structure and high purity make it suitable for precise applications in medicinal chemistry and material science. The product is typically characterized by reliable synthesis protocols and rigorous quality control.
4-(Piperazinomethyl)benzoic Acid, Dihydrochloride structure
86620-70-4 structure
Product Name:4-(Piperazinomethyl)benzoic Acid, Dihydrochloride
CAS No:86620-70-4
MF:C12H17ClN2O2
MW:256.728582143784
MDL:MFCD09753579
CID:991807
Update Time:2025-05-27

4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Chemical and Physical Properties

Names and Identifiers

    • 4-(Piperazin-1-ylmethyl)benzoic acid dihydrochloride
    • 4-(Piperazinomethyl)benzoic Acid, Dihydrochloride
    • 4-(Piperazinomethyl)
    • 4-(PIPERAZINOMETHYL)BENZOIC ACID, DIHYDROCHLORIDE,WHITE SOLID
    • 4-(PIPERAZIN-1-YLMETHYL)BENZOIC ACID 2HCL
    • 4-[(piperazin-1-yl)methyl]benzoic acid dihydrochloride
    • AB0044001
    • ST2418036
    • Z5219
    • Z1245633912
    • Benzoic acid, 4-(1-piperazinylmethyl)-, dihydrochloride (9CI)
    • MDL: MFCD09753579
    • Inchi: 1S/C12H16N2O2.ClH/c15-12(16)11-3-1-10(2-4-11)9-14-7-5-13-6-8-14;/h1-4,13H,5-9H2,(H,15,16);1H
    • InChI Key: XQLWJXZAUHIVQE-UHFFFAOYSA-N
    • SMILES: Cl.O=C(C1C=CC(CN2CCNCC2)=CC=1)O

Computed Properties

  • Exact Mass: 292.07500
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 231
  • Topological Polar Surface Area: 52.6

Experimental Properties

  • Melting Point: 312-340°C dec.
  • PSA: 52.57000
  • LogP: 2.66070

4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Customs Data

  • HS CODE:2933599090
  • Customs Data:

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. 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, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Production Method

Production Method 1

Reaction Conditions
1.1 Solvents: Ethanol ;  20 °C; 16 h, reflux; reflux → rt
1.2 Reagents: Hydrochloric acid Solvents: Water ;  acidified, cooled
Reference
Imatinib analogs as potential agents for PET imaging of Bcr-Abl and c-KIT expression at a kinase level
Peng, Zhenghong; et al, Bioorganic & Medicinal Chemistry, 2014, 22(1), 623-632

4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Raw materials

4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Preparation Products

4-(Piperazinomethyl)benzoic Acid, Dihydrochloride Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:86620-70-4)4-(Piperazinomethyl)benzoic Acid, Dihydrochloride
Order Number:A863105
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 08:39
Price ($):302.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:86620-70-4)4-(Piperazinomethyl)benzoic Acid, Dihydrochloride
A863105
Purity:99%
Quantity:5g
Price ($):302.0
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