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Home> Encyclopedia > Hot Product Listed 4   > 4H-1,3,5-Dithiazine,dihydro-4,6-dimethyl-2-(2-methylpropyl)-
452949-78-9 structure

4H-1,3,5-Dithiazine,dihydro-4,6-dimethyl-2-(2-methylpropyl)-

Iupac Name:2-[(3-phenoxyphenyl)methylidene]-4H-1,4-benzothiazin-3-one
CAS No.:452949-78-9
Molecular Weight:345.416
Molecular Formula:C17H20N2O4 (isomer)
Names and Identifiers
Synonyms

1,3,5-dithiazine, perhydro, 4,6-dimethyl-2-(2-methylpropyl) 2,4-Dimethyl-6-isobutyl-1,3,5-dithiazine 2-isobutyl-4,6-dimethyl-1,3,5-dithiazinane 2-Isobutyl-4,6-dimethyldihydro-4H-1,3,5-dithiazine 2-Isobutyl-4,6-dimethyldihydro-4H-1,3,5-dithiazine >=80.0% 4,6-dimethyl-2-(2-methylpropyl)-1,3,5-dithiazinane 4.6-Dimethyldihydro-4H--2-Isobutyl -1.3.5-dithiazine 4.6-Dimethyldihydro-4H--2-Isobutyl-1.3.5-dithiazine AB1006059 AC1LB4GD AC1Q7FVE AN-34232 DB-003281 dihydro-4,6-dimethyl-2-(2-methylpropyl)-4h-1,3,5-dithiazine FVPPILNIVWRBNY-UHFFFAOYSA-N SCHEMBL10515734

Inchi
InChI=1S/C21H15NO2S/c23-21-20(25-19-12-5-4-11-18(19)22-21)14-15-7-6-10-17(13-15)24-16-8-2-1-3-9-16/h1-14H,(H,22,23)
InChkey
VJAIGORKICOCIT-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C3C(=O)NC4=CC=CC=C4S3
Properties
Flash Point
195 ºC
Safety and Handling
Specification

 2-Isobutyl-4,6-dimethyldihydro-4H-1,3,5-dithiazine (CAS NO.101517-87-7), its Synonyms are 4H-1,3,5-Dithiazine,dihydro-4,6-dimethyl-2-(2-methylpropyl)- ; 1,3,5-Dithiazine, perhydro, 4,6-dimethyl-2-(2-methylpropyl) .

Computational chemical data
  • Molecular Weight:345.416g/mol
  • Molecular Formula:C17H20N2O4
  • Compound Is Canonicalized:True
  • Exact Mass:345.082
  • Monoisotopic Mass:345.082
  • Complexity:500
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Heavy Atom Count:25
  • 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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Recommended Suppliers
  • Tel:+ 44 1248 354103 extn 205
  • Fax:+ 44 1248 352497
  • Tel:+49 721 95061-0
  • Fax:+49 721 95061-80
 
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