Cas no 58315-38-1 (1-2-Nitro-4-(trifluoromethyl)phenylpiperazine)

1-2-Nitro-4-(trifluoromethyl)phenylpiperazine is a specialized chemical compound featuring a piperazine core substituted with a nitro and trifluoromethylphenyl group. This structure imparts unique electronic and steric properties, making it valuable in pharmaceutical and agrochemical research. The nitro group enhances reactivity in nucleophilic substitution reactions, while the trifluoromethyl moiety contributes to increased lipophilicity and metabolic stability. The compound is particularly useful as an intermediate in the synthesis of bioactive molecules, including potential CNS-active agents. Its well-defined structure and high purity ensure consistent performance in synthetic applications. Proper handling is required due to its sensitivity to light and moisture. Suitable for research and development purposes under controlled conditions.
1-2-Nitro-4-(trifluoromethyl)phenylpiperazine structure
58315-38-1 structure
Product Name:1-2-Nitro-4-(trifluoromethyl)phenylpiperazine
CAS No:58315-38-1
MF:C11H12F3N3O2
MW:275.22709274292
MDL:MFCD00052613
CID:366934
PubChem ID:2771407
Update Time:2025-06-07

1-2-Nitro-4-(trifluoromethyl)phenylpiperazine Chemical and Physical Properties

Names and Identifiers

    • Piperazine,1-[2-nitro-4-(trifluoromethyl)phenyl]-
    • 1-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
    • N-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine
    • [2-nitro-4-(trifluoromethyl)phenyl]piperazine
    • 1-(2-Nitro-4-trifluoromethylphenyl)-piperazine
    • BB 0245822
    • (4-trifluromethyl-2-nitrophenyl)piperazine
    • 3-Nitro-4-(piperazin-1-yl)benzotrifluoride
    • n-(2-nitro-4-(trifluoromethyl)phenyl)piperazine
    • AKOS000288825
    • SCHEMBL615409
    • PS-6716
    • 1-(2-Nitro-4-trifluoromethyl-phenyl)-piperazin e
    • SR-01000429637-1
    • FT-0607101
    • 1-(2-Nitro-4-trifluoromethyl-phenyl)-piperazine
    • J-504092
    • EN300-40661
    • DTXSID10377937
    • VHHZVCJGPKXDIC-UHFFFAOYSA-N
    • MFCD00052613
    • 1-(2-Nitro-4-(trifluoromethyl)phenyl)piperazine
    • 58315-38-1
    • SR-01000429637
    • A831827
    • EU-0004535
    • AB00093269-01
    • DB-017377
    • STK013417
    • BBL002982
    • 1-2-Nitro-4-(trifluoromethyl)phenylpiperazine
    • MDL： MFCD00052613
    • Inchi： 1S/C11H12F3N3O2/c12-11(13,14)8-1-2-9(10(7-8)17(18)19)16-5-3-15-4-6-16/h1-2,7,15H,3-6H2
    • InChI Key： YOBUPGXTLFRIJD-UHFFFAOYSA-N
    • SMILES： FC(C1C=CC(=C(C=1)[N+](=O)[O-])N1CCNCC1)(F)F

Computed Properties

  • Exact Mass: 275.08800
  • Monoisotopic Mass: 275.08816112g/mol
  • Isotope Atom Count: nothing
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: nothing
  • Covalently-Bonded Unit Count: nothing
  • Defined Atom Stereocenter Count: nothing
  • Undefined Atom Stereocenter Count : nothing
  • Defined Bond Stereocenter Count: nothing
  • Undefined Bond Stereocenter Count: nothing
  • Surface Charge: nothing
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 61.1?2

Experimental Properties

  • Color/Form: Not determined
  • Melting Point: 65 °C
  • PSA: 61.09000
  • LogP: 2.94020

1-2-Nitro-4-(trifluoromethyl)phenylpiperazine Security Information

  • Hazard Statement： Irritant
  • Hazard Category Code： 36/37/38
  • Safety Instruction： S26-S36/37/39
  • Hazardous Material Identification： Xi
  • Safety Term：S26;S36/37/39;S45
  • Risk Phrases：R36/37/38

1-2-Nitro-4-(trifluoromethyl)phenylpiperazine 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%

1-2-Nitro-4-(trifluoromethyl)phenylpiperazine Pricemore >>

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