Cas no 2248199-35-9 ((2R)-2-Isoquinolin-6-ylpropanoic acid)

(2R)-2-Isoquinolin-6-ylpropanoic acid structure
2248199-35-9 structure
Product Name:(2R)-2-Isoquinolin-6-ylpropanoic acid
CAS No:2248199-35-9
MF:C12H11NO2
MW:201.221243143082
CID:5926505
PubChem ID:137939954
Update Time:2023-12-14

(2R)-2-Isoquinolin-6-ylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2248199-35-9
    • (2R)-2-(isoquinolin-6-yl)propanoic acid
    • EN300-6505477
    • (2R)-2-Isoquinolin-6-ylpropanoic acid
    • Inchi: 1S/C12H11NO2/c1-8(12(14)15)9-2-3-11-7-13-5-4-10(11)6-9/h2-8H,1H3,(H,14,15)/t8-/m1/s1
    • InChI Key: DDKKHBSKWKYZIL-MRVPVSSYSA-N
    • SMILES: OC([C@H](C)C1C=CC2C=NC=CC=2C=1)=O

Computed Properties

  • Exact Mass: 201.078978594g/mol
  • Monoisotopic Mass: 201.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 242
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 50.2?2

(2R)-2-Isoquinolin-6-ylpropanoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
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(2R)-2-(isoquinolin-6-yl)propanoic acid
2248199-35-9 95.0%
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