Cas no 55480-45-0 (3-(4-Methylpiperazin-1-yl)propanoic acid)

3-(4-Methylpiperazin-1-yl)propanoic acid is a versatile intermediate in organic synthesis, particularly valued for its piperazine moiety, which is widely utilized in pharmaceutical and agrochemical applications. The compound features a carboxylic acid functional group, enabling further derivatization through amidation, esterification, or other coupling reactions. Its methylpiperazine component enhances solubility and bioavailability, making it a useful building block in drug discovery. The structural stability and reactivity of this compound make it suitable for the development of biologically active molecules, including kinase inhibitors and CNS-targeting agents. High purity grades are available to meet stringent research and industrial requirements.
3-(4-Methylpiperazin-1-yl)propanoic acid structure
55480-45-0 structure
Product Name:3-(4-Methylpiperazin-1-yl)propanoic acid
CAS No:55480-45-0
MF:C8H16N2O2
MW:172.224842071533
MDL:MFCD00513444
CID:366935
PubChem ID:1395380
Update Time:2025-06-09

3-(4-Methylpiperazin-1-yl)propanoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(4-Methylpiperazin-1-yl)propanoic acid
    • 3-(4-Methyl-1-piperazinyl)propanoic Acid
    • 1-Piperazinepropanoicacid, 4-methyl-
    • 3-(4-Methyl-piperazin-1-yl)-propionic acid
    • 3-(4-METHYLPIPERAZIN-1-YL)PROPIONIC ACID
    • 3-(N-METHYLPIPERAZINE)-PROPAN-1-OIC ACID HYDROCHLORIDE SALT
    • AKOS000271435
    • FT-0618992
    • 1-Piperazinepropanoic acid, 4-methyl-
    • 3-(4-methylpiperazine-1-yl) propionic acid
    • 4-methyl-1-piperazinepropanoic acid
    • BS-3939
    • 3-(4-Methylpiperazin-1-yl)propanoic acid, AldrichCPR
    • 3-(4-Methyl-piperazin-1-yl)-propionicacid
    • A830665
    • 1-Pyrazinepropanoic acid, hexahydro-4-methyl-
    • SY022672
    • MFCD00513444
    • 3-(4-Methyl-1-piperazinyl)propanoicAcid
    • CS-0205907
    • BB 0219039
    • DTXSID50362761
    • Oprea1_767673
    • Z53116013
    • 3-(4-methyl-1-piperazinyl)propionic acid
    • 55480-45-0
    • SCHEMBL954925
    • ALBB-011996
    • BBL005504
    • STK392446
    • DB-021672
    • MDL: MFCD00513444
    • Inchi: 1S/C8H16N2O2/c1-9-4-6-10(7-5-9)3-2-8(11)12/h2-7H2,1H3,(H,11,12)
    • InChI Key: JSHLMMUXJIDENZ-UHFFFAOYSA-N
    • SMILES: OC(CCN1CCN(C)CC1)=O

Computed Properties

  • Exact Mass: 172.12100
  • Monoisotopic Mass: 172.121
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 153
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: -2.7
  • Topological Polar Surface Area: 43.8A^2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.4±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 305.5 ℃ at 760 mmHg
  • Flash Point: No data available
  • Refractive Index: 1.494
  • PSA: 43.78000
  • LogP: -0.41570
  • Vapor Pressure: No data available

3-(4-Methylpiperazin-1-yl)propanoic acid Security Information

3-(4-Methylpiperazin-1-yl)propanoic acid 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%

3-(4-Methylpiperazin-1-yl)propanoic acid Pricemore >>

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3-(4-Methylpiperazin-1-yl)propanoic acid Production Method

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