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Home> Encyclopedia > Hot Product Listed 6   > 6,9,12-Octadecatrienoicacid, ethyl ester, (6Z,9Z,12Z)-
793615-37-9 structure

6,9,12-Octadecatrienoicacid, ethyl ester, (6Z,9Z,12Z)-

Iupac Name:(5-methyl-7-propylimidazo[1,5-b]pyridazin-2-yl)hydrazine
CAS No.:793615-37-9
Molecular Weight:205.265
Molecular Formula:C13H10N2O4S2 (isomer)
Names and Identifiers
Synonyms

6,9,12-Octadecatrienoicacid, ethyl ester, (Z,Z,Z)- Ethyl g-linolenate Ethyl g-linolenic acid g-Linolenic acid, ethyl ester (6CI,8CI)

Inchi
InChI=1S/C10H15N5/c1-3-4-10-12-7(2)8-5-6-9(13-11)14-15(8)10/h5-6H,3-4,11H2,1-2H3,(H,13,14)
InChkey
BMBKZFFBXBCQBP-UHFFFAOYSA-N
Canonical Smiles
CCCC1=NC(=C2N1N=C(C=C2)NN)C
Properties
Storage temp
−20°C
Computational chemical data
  • Molecular Weight:205.265g/mol
  • Molecular Formula:C13H10N2O4S2
  • Compound Is Canonicalized:True
  • Exact Mass:205.133
  • Monoisotopic Mass:205.133
  • Complexity:210
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:68.2A^2
  • Heavy Atom Count:15
  • 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: AAADccBzgAAAAAAAAAAAAAAAAAAAAWAAAAAsAAAAAAAAAFgB4AAAHAAYAAAACAiBFwAz8LZqEACi ASZiZACShC8hEqIduCAwdJiIaKLAmJGUoAh4mALIyCcQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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