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Home> Hot Product Listed T   > T6618121
98112-77-7 structure

T6618121

CAS No.:98112-77-7
Molecular Weight:182.2179
Molecular Formula:C11H8CLF3N2O4 (isomer)
Names and Identifiers
Synonyms

7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-4-fluoro-3-methyl-2,3-dihydro-1h-inden-1-one 7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-4-fluoro-3-methyl-2,3-dihydroinden-1-one MCULE-6541309488 MOLPORT-009-139-657 Z134652440

Inchi
InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2
Canonical Smiles
C1C2=CC=CC=C2OC3=CC=CC=C31
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 98112-77-7 EC: T6618121 ·ECHA C&L Inventory for CAS: CAS: 98112-77-7 EC: T6618121
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:182.2179g/mol
  • Molecular Formula:C11H8CLF3N2O4
  • Exact Mass:182.073165
  • Monoisotopic Mass:182.073165
  • Complexity:181
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:9.2
  • Heavy Atom Count:14
  • 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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