Cas no 952800-36-1 (methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate)

Methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate is a heterocyclic compound featuring a pyrrolopyridine core with a chloro substituent at the 7-position and a methyl ester group at the 2-position. This structure serves as a versatile intermediate in pharmaceutical and agrochemical synthesis, particularly in the development of biologically active molecules. The chloro and ester functional groups enhance reactivity, enabling further derivatization through cross-coupling, hydrolysis, or substitution reactions. Its rigid fused-ring system contributes to stability while maintaining compatibility with diverse synthetic routes. The compound is commonly utilized in medicinal chemistry research for constructing scaffolds with potential therapeutic applications, including kinase inhibitors and antimicrobial agents. Proper handling under controlled conditions is recommended due to its reactive functional groups.
methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate structure
952800-36-1 structure
Product Name:methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
CAS No:952800-36-1
MF:C9H7ClN2O2
MW:210.617080926895
MDL:MFCD09864652
CID:1985803
PubChem ID:45073300
Update Time:2025-05-23

methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
    • LogP
    • ethyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
    • Methyl 7-chloro-1H-pyrrolo-[3,2-b]pyridine-2-carboxylate
    • Methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate (ACI)
    • P10811
    • Methyl7-chloro-1H-pyrrolo-[3,2-b]pyridine-2-carboxylate
    • DTXSID40662722
    • CNB80036
    • PB14756
    • MFCD09864652
    • AS-50655
    • AKOS015945661
    • 952800-36-1
    • CS-0048916
    • MDL： MFCD09864652
    • Inchi： 1S/C9H7ClN2O2/c1-14-9(13)7-4-6-8(12-7)5(10)2-3-11-6/h2-4,12H,1H3
    • InChI Key： DQBUZBSXMBSOIM-UHFFFAOYSA-N
    • SMILES： O=C(C1NC2C(=NC=CC=2Cl)C=1)OC

Computed Properties

  • Exact Mass: 210.0196052g/mol
  • Monoisotopic Mass: 210.0196052g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 237
  • 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: 1.9
  • Topological Polar Surface Area: 55?2

methyl 7-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate Pricemore >>

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