Cas no 7114-81-0 (isoquinoline-4-carboxamide)

isoquinoline-4-carboxamide structure
isoquinoline-4-carboxamide structure
Product Name:isoquinoline-4-carboxamide
CAS No:7114-81-0
MF:C10H8N2O
MW:172.18332195282
MDL:MFCD09999538
CID:545978
PubChem ID:599020
Update Time:2025-04-19

isoquinoline-4-carboxamide Chemical and Physical Properties

Names and Identifiers

    • 4-Isoquinolinecarboxamide
    • isoquinoline-4-carboxamide
    • 4-Aminocarbonylisoquinoline
    • 4-Carbamoylisoquinoline
    • AC1LCCBO
    • CTK2H3994
    • Isochinolin-4-carbonsaeure-amid
    • Isochinolin-carbonsaeureamid-4
    • isoquinoline-4-carboxylic acid amide
    • SureCN1121657
    • W16187
    • AKOS022882218
    • EN300-217590
    • JGNIYFRSFZEFCQ-UHFFFAOYSA-N
    • MFCD09999538
    • 4-Isoquinolinecarboxamide #
    • DTXSID00344719
    • 7114-81-0
    • SCHEMBL1121657
    • CS-0239682
    • AS-58543
    • MDL: MFCD09999538
    • Inchi: 1S/C10H8N2O/c11-10(13)9-6-12-5-7-3-1-2-4-8(7)9/h1-6H,(H2,11,13)
    • InChI Key: JGNIYFRSFZEFCQ-UHFFFAOYSA-N
    • SMILES: O=C(C1=CN=CC2C=CC=CC=21)N

Computed Properties

  • Exact Mass: 172.06374
  • Monoisotopic Mass: 172.063662883g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 205
  • 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
  • Topological Polar Surface Area: 56?2

Experimental Properties

  • PSA: 55.98

isoquinoline-4-carboxamide Pricemore >>

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isoquinoline-4-carboxamide Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:7114-81-0)isoquinoline-4-carboxamide
Order Number:A1172626
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:23
Price ($):554.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:7114-81-0)isoquinoline-4-carboxamide
A1172626
Purity:99%
Quantity:1g
Price ($):554.0
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