Cas no 514209-40-6 (2-(4-Methylpiperazin-1-ylmethyl)benzoic acid)

2-(4-Methylpiperazin-1-ylmethyl)benzoic acid structure
514209-40-6 structure
Product Name:2-(4-Methylpiperazin-1-ylmethyl)benzoic acid
CAS No:514209-40-6
MF:C13H18N2O2
MW:234.294223308563
MDL:MFCD06797777
CID:821094
PubChem ID:4769784
Update Time:2025-09-18

2-(4-Methylpiperazin-1-ylmethyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-Methylpiperazin-1-ylmethyl)benzoic acid
    • 2-[(4-methylpiperazin-1-yl)methyl]benzoic acid
    • DB-001752
    • 2-(4-Methylpiperazin-1-ylmethyl)benzoicacid
    • DTXSID90406375
    • MFCD06797777
    • J-505245
    • AKOS000293144
    • EN300-1196687
    • 514209-40-6
    • GS-4463
    • 2-((4-methylpiperazin-1-yl)methyl)benzoic acid
    • CS-0117918
    • SCHEMBL3454127
    • 2-(4-methylpiperazin-1-ylmethyl)benzoic acid, AldrichCPR
    • SY109758
    • 2-[(4-methyl-1-piperazinyl)methyl]benzoic acid
    • MDL: MFCD06797777
    • Inchi: 1S/C13H18N2O2/c1-14-6-8-15(9-7-14)10-11-4-2-3-5-12(11)13(16)17/h2-5H,6-10H2,1H3,(H,16,17)
    • InChI Key: QFGAZCPGMRUCDN-UHFFFAOYSA-N
    • SMILES: OC(C1C=CC=CC=1CN1CCN(C)CC1)=O

Computed Properties

  • Exact Mass: 234.13700
  • Monoisotopic Mass: 234.136827821g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 262
  • 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: -1.2
  • Topological Polar Surface Area: 43.8?2

Experimental Properties

  • PSA: 43.78000
  • LogP: 1.00800

2-(4-Methylpiperazin-1-ylmethyl)benzoic 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%

2-(4-Methylpiperazin-1-ylmethyl)benzoic acid Pricemore >>

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