Cas no 90721-35-0 (5-Bromoisoquinolin-8-amine)

5-Bromoisoquinolin-8-amine structure
5-Bromoisoquinolin-8-amine structure
Product Name:5-Bromoisoquinolin-8-amine
CAS No:90721-35-0
MF:C9H7BrN2
MW:223.069280862808
MDL:MFCD09261047
CID:61435
PubChem ID:16218302
Update Time:2024-10-26

5-Bromoisoquinolin-8-amine Chemical and Physical Properties

Names and Identifiers

    • 5-Bromoisoquinolin-8-ylamine
    • 5-Bromoisoquinolin-8-amine
    • 5-Bromo-8-aminoquinoline
    • 5-Bromo-isoquinolin-8-ylamine
    • 8-Amino-5-bromoisoquinoline
    • 5-Bromo-8-isoquinolinamine
    • 5-Bromo-8-isoquinolineamine
    • 8-ISOQUINOLINAMINE, 5-BROMO-
    • PubChem20332
    • 5- Bromoisoquinolin-8-amine
    • BTFXYVXBWMRHIB-UHFFFAOYSA-N
    • 8-AMINO-5-BROMISOQUINOLINE
    • EBD24052
    • 5-BROMO-8-AMINOISOQUINOLINE
    • BCP01514
    • 5-Bromo-8-isoquinolinamine (ACI)
    • Isoquinoline, 8-amino-5-bromo- (7CI)
    • AC-9426
    • J-517168
    • MFCD09261047
    • CHEMBL4848146
    • 90721-35-0
    • AB50046
    • AKOS005256533
    • EN300-174570
    • CS-0037082
    • 8-Amino-5-bromoisoquinoline, 90%
    • SY065639
    • BDBM50578093
    • DTXSID50584865
    • SCHEMBL246823
    • TS-03182
    • MDL: MFCD09261047
    • Inchi: 1S/C9H7BrN2/c10-8-1-2-9(11)7-5-12-4-3-6(7)8/h1-5H,11H2
    • InChI Key: BTFXYVXBWMRHIB-UHFFFAOYSA-N
    • SMILES: BrC1C2C(=CN=CC=2)C(N)=CC=1

Computed Properties

  • Exact Mass: 221.97900
  • Monoisotopic Mass: 221.97926g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 163
  • 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
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 2.1
  • Topological Polar Surface Area: 38.9

Experimental Properties

  • Density: 1.649
  • Melting Point: 186-190?°C
  • Boiling Point: 370.3°C at 760 mmHg
  • Flash Point: 177.7 °C
  • Refractive Index: 1.732
  • PSA: 38.91000
  • LogP: 3.16070

5-Bromoisoquinolin-8-amine Security Information

  • Symbol: GHS06
  • Signal Word:Danger
  • Hazard Statement: H301-H319
  • Warning Statement: P301+P310-P305+P351+P338
  • Hazardous Material transportation number:UN 2811
  • WGK Germany:3
  • Hazard Category Code: 25-36
  • Safety Instruction: 26-45
  • Hazardous Material Identification: T
  • Storage Condition:Keep in dark place,Inert atmosphere,Room temperature(BD103021)
  • Risk Phrases:R25; R36

5-Bromoisoquinolin-8-amine Customs Data

  • HS CODE:2933499090
  • Customs Data:

    China Customs Code:

    2933499090

    Overview:

    2933499090. Other compounds containing quinoline or isoquinoline ring system [but not further fused]. 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:

    2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-Bromoisoquinolin-8-amine Pricemore >>

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5-Bromoisoquinolin-8-amine Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Iron ,  Ammonium chloride Solvents: Methanol ,  Water ;  3 h, reflux
Reference
Synthesis and SAR exploration of dinapsoline analogues
Sit, Sing-Yuen; Xie, Kai; Jacutin-Porte, Swanee; Boy, Kenneth M.; Seanz, James; et al, Bioorganic & Medicinal Chemistry, 2004, 12(4), 715-734

5-Bromoisoquinolin-8-amine Raw materials

5-Bromoisoquinolin-8-amine Preparation Products

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