Cas no 287114-27-6 (1-(5-Nitropyridin-2-yl)-1,4-diazepane)

1-(5-Nitropyridin-2-yl)-1,4-diazepane structure
287114-27-6 structure
Product Name:1-(5-Nitropyridin-2-yl)-1,4-diazepane
CAS No:287114-27-6
MF:C10H14N4O2
MW:222.243761539459
MDL:MFCD01311911
CID:254211
PubChem ID:2737091
Update Time:2025-04-19

1-(5-Nitropyridin-2-yl)-1,4-diazepane Chemical and Physical Properties

Names and Identifiers

    • 1H-1,4-Diazepine,hexahydro-1-(5-nitro-2-pyridinyl)-
    • 1-(5-Nitro-2-pyridyl)-1,4-diazepane
    • 1-(5-NITROPYRID-2-YL)HOMOPIPERAZINE
    • 1-(5-Nitropyridin-2-yl)homopiperazine
    • CS-0316263
    • MFCD01311911
    • 1-(5-nitropyridin-2-yl)-1,4-diazepane
    • 287114-27-6
    • Maybridge1_000445
    • 1-(5-nitropyridin-2-yl)-1, 4-diazepane
    • 1H-1,4-Diazepine, hexahydro-1-(5-nitro-2-pyridinyl)-
    • 1-(5-nitro-pyridin-2-yl)-[1,4]diazepane
    • SCHEMBL2003294
    • AKOS000129499
    • FT-0605796
    • AS-78420
    • HMS542M05
    • DTXSID60951362
    • Oprea1_353430
    • 1-(5-nitro-2-pyridinyl)-1,4-diazepane
    • AS-871/43475565
    • 1-(5-Nitropyridin-2-yl)-1,4-diazepane
    • MDL： MFCD01311911
    • Inchi： 1S/C10H14N4O2/c15-14(16)9-2-3-10(12-8-9)13-6-1-4-11-5-7-13/h2-3,8,11H,1,4-7H2
    • InChI Key： HVIKXFXKZFWDTQ-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1=CN=C(C=C1)N1CCNCCC1)=O

Computed Properties

  • Exact Mass: 222.11200
  • Monoisotopic Mass: 222.112
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 244
  • 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: 0.8
  • Topological Polar Surface Area: 74?2

Experimental Properties

  • Density: 1.23
  • Melting Point: 111 °C
  • Boiling Point: 421.8°Cat760mmHg
  • Flash Point: 208.9°C
  • Refractive Index: 1.567
  • PSA: 73.98000
  • LogP: 1.70650

1-(5-Nitropyridin-2-yl)-1,4-diazepane Security Information

  • Hazard Statement： Irritant
  • Hazardous Material transportation number：UN 2921
  • Hazard Category Code： 10-34
  • Safety Instruction： S16; S26; S36
  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT
  • Risk Phrases：R10

1-(5-Nitropyridin-2-yl)-1,4-diazepane Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. 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:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1-(5-Nitropyridin-2-yl)-1,4-diazepane Pricemore >>

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