Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed M   > MOLPORT-009-029-045
1190312-37-8 structure

MOLPORT-009-029-045

Iupac Name:methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-4-carboxylate
CAS No.:1190312-37-8
Molecular Weight:210.617
Molecular Formula:C19H21NO6 (isomer)
Names and Identifiers
Synonyms

MCULE-2761342129 methyl 2-(3-oxo-1-{2-[4-(phenylamino)phenoxy]acetyl}piperazin-2-yl)acetate Z29974261

Inchi
InChI=1S/C9H7ClN2O2/c1-14-9(13)6-4-7(10)12-8-5(6)2-3-11-8/h2-4H,1H3,(H,11,12)
InChkey
FNKIBYKKYBUANQ-UHFFFAOYSA-N
Canonical Smiles
COC(=O)C1=CC(=NC2=C1C=CN2)Cl
Computational chemical data
  • Molecular Weight:210.617g/mol
  • Molecular Formula:C19H21NO6
  • Compound Is Canonicalized:True
  • Exact Mass:210.02
  • Monoisotopic Mass:210.02
  • Complexity:237
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:55A^2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBzMAAEAAAAAAAAAAAAAAAAAWAAAAAsAAAAAAAAAFgB+AAAHgIQAAAADALBmyY/uN7JlACo AjL3bACCgCm1B6AJ2aE4btiILvLBvpmEMQhs0API6ae8EQIOgAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-755-33239182
  • Fax:86-755-33233381
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-755-33239182
  • Fax:86-755-33233381
 
<