Cas no 31721-17-2 (quinupramine)

quinupramine structure
quinupramine structure
Product Name:quinupramine
CAS No:31721-17-2
MF:C21H24N2
MW:304.428665161133
CID:94174
PubChem ID:93154
Update Time:2025-04-18

quinupramine Chemical and Physical Properties

Names and Identifiers

    • quinupramine
    • 11-(1-azabicyclo[2.2.2]octan-3-yl)-5,6-dihydrobenzo[b][1]benzazepine
    • Kevopril
    • Kinupril
    • Quinupramina
    • Quinupraminum
    • CHEMBL107360
    • CHEBI:135292
    • D07336
    • Quinupramine (INN)
    • QUINUPRAMINE [MART.]
    • 31721-17-2
    • Quinupramine [INN:DCF]
    • QUINUPRAMINE [INN]
    • EINECS 250-780-3
    • 2-{1-azabicyclo[2.2.2]octan-3-yl}-2-azatricyclo[9.4.0.0,3,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
    • 5-(3-Chinuclidinyl)-10,11-dihydro-5H-dibenz(b,f)azepin
    • QUINUPRAMINE [WHO-DD]
    • DB13246
    • NS00002301
    • Q7272541
    • Kevopril; Kinupril; LM 208
    • QUINUPRAMINE [MI]
    • Oprea1_740272
    • UNII-29O61HFF4L
    • Quinupraminum [INN-Latin]
    • SCHEMBL49100
    • 10,11-Dihydro-5-(3-quinuclidinyl)-5H-dibenz(b,f)azepine
    • 29O61HFF4L
    • DTXSID70865608
    • HY-106578
    • Quinupramina [INN-Spanish]
    • FT-0674293
    • 5H-Dibenz(b,f)azepine, 10,11-dihydro-5-(3-quinuclidinyl)-
    • CS-0026094
    • EN300-18563724
    • 2-(1-azabicyclo(2.2.2)octan-3-yl)-2-azatricyclo(9.4.0.0^(3,8))pentadeca-1(15),3,5,7,11,13-hexaene
    • QUINUPRAMINE (MART.)
    • 2-{1-azabicyclo[2.2.2]octan-3-yl}-2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,11,13-hexaene
    • Quinupraminum (INN-Latin)
    • JCBQCKFFSPGEDY-UHFFFAOYSA-N
    • Quinupramina (INN-Spanish)
    • N06AA23
    • Inchi: 1S/C21H24N2/c1-3-7-19-16(5-1)9-10-17-6-2-4-8-20(17)23(19)21-15-22-13-11-18(21)12-14-22/h1-8,18,21H,9-15H2
    • InChI Key: JCBQCKFFSPGEDY-UHFFFAOYSA-N
    • SMILES: N12CCC(CC1)C(C2)N1C2C=CC=CC=2CCC2=CC=CC=C12

Computed Properties

  • Exact Mass: 304.19400
  • Monoisotopic Mass: 304.193948774g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 1
  • Complexity: 390
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.5
  • Topological Polar Surface Area: 6.5?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Melting Point: 150°
  • Boiling Point: 445.2±44.0 °C at 760 mmHg
  • Flash Point: 201.7±16.3 °C
  • PSA: 6.48000
  • LogP: 4.02040
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

quinupramine Security Information

  • Signal Word:warning
  • Hazard Statement: H303+H313+H333
  • Warning Statement: P264+P280+P305+P351+P338+P337+P313
  • Hazardous Material transportation number:UN 3249
  • Safety Instruction: H303+H313+H333
  • HazardClass:6.1(b)
  • PackingGroup:III
  • Safety Term:6.1(b)
  • Packing Group:III
  • Packing Group:III
  • Hazard Level:6.1(b)
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

quinupramine 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%

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