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Home> Encyclopedia > Hot Product Listed M   > MCULE-9144058128
338954-28-2 structure

MCULE-9144058128

Iupac Name:1-[2-[(5-chlorothiadiazol-4-yl)methoxy]phenyl]-N-methoxymethanimine
CAS No.:338954-28-2
Molecular Weight:283.73
Molecular Formula:C11H10ClN3O2S (isomer)
Names and Identifiers
Synonyms

({2-[(5-chloro-1,2,3-thiadiazol-4-yl)methoxy]phenyl}methylidene)(methoxy)amine 2-[(5-chloro-1,2,3-thiadiazol-4-yl)methoxy]benzenecarbaldehyde o-methyloxime AC1MXAZZ KS-00003996

Inchi
InChI=1S/C11H10ClN3O2S/c1-16-13-6-8-4-2-3-5-10(8)17-7-9-11(12)18-15-14-9/h2-6H,7H2,1H3
InChkey
HNCYRHFCWXLKBU-UHFFFAOYSA-N
Canonical Smiles
CON=CC1=CC=CC=C1OCC2=C(SN=N2)Cl
Computational chemical data
  • Molecular Weight:283.73g/mol
  • Molecular Formula:C11H10ClN3O2S
  • Compound Is Canonicalized:True
  • Exact Mass:283.018
  • Monoisotopic Mass:283.018
  • Complexity:283
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:6
  • Heavy Atom Count:18
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:1
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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