Cas no 80947-25-7 (2-Chloroquinolin-4-amine)

2-Chloroquinolin-4-amine structure
2-Chloroquinolin-4-amine structure
Product Name:2-Chloroquinolin-4-amine
CAS No:80947-25-7
MF:C9H7ClN2
MW:178.618280649185
MDL:MFCD08705643
CID:707939
PubChem ID:12884651
Update Time:2024-10-27

2-Chloroquinolin-4-amine Chemical and Physical Properties

Names and Identifiers

    • 2-Chloroquinolin-4-amine
    • 4-AMINO-2-CHLOROQUINOLINE
    • 4-Quinolinamine,2-chloro-
    • (2-Chloroquinolin-4-yl)amine
    • 2-Chloro-4-quinolinamine (ACI)
    • Quinoline, 4-amino-2-chloro- (6CI)
    • DB-081614
    • MB06583
    • FS-3735
    • CS-W006264
    • QVCRGJALYOLXDC-UHFFFAOYSA-N
    • DTXSID00512279
    • 80947-25-7
    • SY037385
    • SCHEMBL1845376
    • EN300-304322
    • MFCD08705643
    • AKOS006288572
    • DS-2719
    • 2-chloro-quinolin-4-ylamine
    • MDL： MFCD08705643
    • Inchi： 1S/C9H7ClN2/c10-9-5-7(11)6-3-1-2-4-8(6)12-9/h1-5H,(H2,11,12)
    • InChI Key： QVCRGJALYOLXDC-UHFFFAOYSA-N
    • SMILES： ClC1C=C(N)C2C(=CC=CC=2)N=1

Computed Properties

  • Exact Mass: 178.03000
  • Monoisotopic Mass: 178.0297759g/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
  • XLogP3: 2.5
  • Topological Polar Surface Area: 38.9?2

Experimental Properties

  • Density: 1.363
  • Melting Point: 250 oC
  • Boiling Point: 366 oC
  • Flash Point: 175 oC
  • Refractive Index: 1.712
  • PSA: 38.91000
  • LogP: 3.05160

2-Chloroquinolin-4-amine Security Information

2-Chloroquinolin-4-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%

2-Chloroquinolin-4-amine Pricemore >>

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2-Chloroquinolin-4-amine Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Phosphorus oxychloride ;  0 °C; 2.5 h, reflux; reflux → rt
1.2 Solvents: Water ;  0 °C
1.3 Reagents: Sodium hydroxide Solvents: Water ;  pH 9
2.1 Reagents: Ammonia Solvents: Water ;  2.5 h, 160 °C
Reference
A Series of 2,4-Disubstituted Quinolines as a New Class of Allosteric Enhancers of the Adenosine A3 Receptor
Heitman, Laura H.; et al, Journal of Medicinal Chemistry, 2009, 52(4), 926-931

Production Method 2

Reaction Conditions
1.1 Reagents: Ammonia Solvents: Water ;  2.5 h, 160 °C
Reference
A Series of 2,4-Disubstituted Quinolines as a New Class of Allosteric Enhancers of the Adenosine A3 Receptor
Heitman, Laura H.; et al, Journal of Medicinal Chemistry, 2009, 52(4), 926-931

2-Chloroquinolin-4-amine Raw materials

2-Chloroquinolin-4-amine Preparation Products

2-Chloroquinolin-4-amine Related Literature

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