Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Encyclopedia > Hot Product Listed 6   > 6,8-Dioxabicyclo[3.2.1]octane,4-bromo-7-propyl-, (1R,4R,5S,7S)-rel-
1415314-22-5 structure

6,8-Dioxabicyclo[3.2.1]octane,4-bromo-7-propyl-, (1R,4R,5S,7S)-rel-

Iupac Name:6-chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine
CAS No.:1415314-22-5
Molecular Weight:279.465
Molecular Formula:C21H30O6 (isomer)
Names and Identifiers
Synonyms

6,8-Dioxabicyclo[3.2.1]octane,4-bromo-7-propyl-, (endo,endo)- (9CI) 6,8-Dioxabicyclo[3.2.1]octane,4-bromo-7-propyl-, (endo,endo)-(?à)- 6,8-Dioxabicyclo3.2.1octane, 4-bromo-7-propyl-, (endo,endo)-

Inchi
InChI=1S/C6H3ClIN3/c7-4-1-5(8)6-9-3-10-11(6)2-4/h1-3H
InChkey
LENYWTQYOHGJLB-UHFFFAOYSA-N
Canonical Smiles
C1=C(C2=NC=NN2C=C1Cl)I
Computational chemical data
  • Molecular Weight:279.465g/mol
  • Molecular Formula:C21H30O6
  • Compound Is Canonicalized:True
  • Exact Mass:278.906
  • Monoisotopic Mass:278.906
  • Complexity:157
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:30.2A^2
  • Heavy Atom Count:11
  • 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: AAADcQBjAAAEAgAAAAAAAAAAAAAAAWAAAAAsAAAAAAAAAFgB4AAAHAIoAAAACALDEyQ9sJ4IEACi ADJnZACShCsxhaAV2CAoRpiIKOLBm5HEoAhoiALIyCYQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-21-63065878-8006 15800915896
  • Fax:
Recommended Suppliers
  • Tel:86-21-63065878-8006 15800915896
  • Fax:
 
<