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Home> Hot Product Listed T   > T6572203
28252-81-5 structure

T6572203

Iupac Name:3,8-dichloro-1,5-naphthyridine
CAS No.:28252-81-5
Molecular Weight:199.034
Molecular Formula:C18H20N2O3S (isomer)
Names and Identifiers
Synonyms

1-(3,4-dihydro-2h-1,4-benzothiazin-4-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethan-1-one MCULE-2622045773 MOLPORT-009-521-451 SCHEMBL16907792 Z88940855 ZINC22944815

Inchi
InChI=1S/C8H4Cl2N2/c9-5-3-7-8(12-4-5)6(10)1-2-11-7/h1-4H
InChkey
BMNVIIMWNOTDPE-UHFFFAOYSA-N
Canonical Smiles
C1=CN=C2C=C(C=NC2=C1Cl)Cl
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:199.034g/mol
  • Molecular Formula:C18H20N2O3S
  • Compound Is Canonicalized:True
  • Exact Mass:197.975
  • Monoisotopic Mass:197.975
  • Complexity:165
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Heavy Atom Count:12
  • 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
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