Cas no 76835-13-7 (1-(4-Nitrobenzyl)piperazine dihydrochloride)

1-(4-Nitrobenzyl)piperazine dihydrochloride structure
76835-13-7 structure
Product Name:1-(4-Nitrobenzyl)piperazine dihydrochloride
CAS No:76835-13-7
MF:C11H17Cl2N3O2
MW:294.177580595016
CID:890108
PubChem ID:18005679
Update Time:2025-04-19

1-(4-Nitrobenzyl)piperazine dihydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Nitrobenzyl)piperazine dihydrochloride
    • TIMTEC-BB SBB002977
    • GGBDAQAYHNRAIY-UHFFFAOYSA-N
    • 76835-13-7
    • 1-[(4-nitrophenyl)methyl]piperazine;dihydrochloride
    • BP-10439
    • 1-(4-nitrobenzyl)-piperazinedihydrochloride
    • SCHEMBL4478110
    • N-(4-nitrobenzyl) piperazine dihydrochloride
    • 1-[(4-nitrophenyl)methyl]piperazine dihydrochloride
    • DTXSID50592440
    • BS-28182
    • A10244
    • 1-(4-NITROBENZYL)PIPERAZINE 2HCL
    • N-(4-nitrobenzyl)piperazine dihydrochloride
    • AKOS015911762
    • FT-0658225
    • 422517-67-7
    • MFCD04972581
    • starbld0009725
    • 1-(4-Nitrobenzyl)piperazinedihydrochloride
    • 1-(4-nitro-benzyl)-piperazine dihydrochloride
    • A825823
    • 1-[(4-Nitrophenyl)methyl]piperazine--hydrogen chloride (1/2)
    • Inchi： 1S/C11H15N3O2.2ClH/c15-14(16)11-3-1-10(2-4-11)9-13-7-5-12-6-8-13;;/h1-4,12H,5-9H2;2*1H
    • InChI Key： GGBDAQAYHNRAIY-UHFFFAOYSA-N
    • SMILES： Cl.Cl.[O-][N+](C1C=CC(=CC=1)CN1CCNCC1)=O

Computed Properties

  • Exact Mass: 293.07000
  • Monoisotopic Mass: 293.0697822g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 228
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 61.1?2

Experimental Properties

  • PSA: 61.09000
  • LogP: 3.39390

1-(4-Nitrobenzyl)piperazine dihydrochloride Security Information

  • Hazard Statement： Irritant
  • Hazardous Material Identification： Xi

1-(4-Nitrobenzyl)piperazine 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%

1-(4-Nitrobenzyl)piperazine dihydrochloride Related Literature

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