Cas no 1000545-64-1 (2-(Isoquinolin-6-yl)acetic acid)

2-(Isoquinolin-6-yl)acetic acid structure
1000545-64-1 structure
Product Name:2-(Isoquinolin-6-yl)acetic acid
CAS No:1000545-64-1
MF:C11H9NO2
MW:187.194662809372
MDL:MFCD09925161
CID:1010923
PubChem ID:19098542
Update Time:2025-04-20

2-(Isoquinolin-6-yl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(Isoquinolin-6-yl)acetic acid
    • 2-isoquinolin-6-ylacetic acid
    • Y6752
    • 6-Isoquinolineacetic acid
    • Isoquinolin-6-yl-acetic acid
    • EN300-316256
    • MFCD09925161
    • DB-058256
    • A898759
    • 1000545-64-1
    • 100054-56-6
    • W-204328
    • SCHEMBL2698312
    • AKOS006312843
    • SB30015
    • (Isoquinolin-6-yl)acetic acid
    • DTXSID60598054
    • 2-(isoquinolin-6-yl)aceticacid
    • 2-?(Isoquinolin-?6-?yl)?acetic acid
    • CS-0215973
    • J-506447
    • MDL： MFCD09925161
    • Inchi： 1S/C11H9NO2/c13-11(14)6-8-1-2-10-7-12-4-3-9(10)5-8/h1-5,7H,6H2,(H,13,14)
    • InChI Key： QBBKZWYMVFEWSI-UHFFFAOYSA-N
    • SMILES： OC(CC1C=CC2C=NC=CC=2C=1)=O

Computed Properties

  • Exact Mass: 187.06300
  • Monoisotopic Mass: 187.063328530g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 217
  • 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: 1.6
  • Topological Polar Surface Area: 50.2?2

Experimental Properties

  • Density: 1.297±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Slightly soluble (3 g/l) (25 o C),
  • PSA: 50.19000
  • LogP: 1.86190

2-(Isoquinolin-6-yl)acetic acid 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%

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2-(Isoquinolin-6-yl)acetic acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:1000545-64-1)2-(Isoquinolin-6-yl)acetic acid
Order Number:A898759
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 12:02
Price ($):2164.0

2-(Isoquinolin-6-yl)acetic acid Related Literature

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Recommended suppliers
Amadis Chemical Company Limited
(CAS:1000545-64-1)2-(Isoquinolin-6-yl)acetic acid
A898759
Purity:99%
Quantity:5g
Price ($):2164.0
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