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Home> Hot Product Listed F   > F2135-0884
1314-98-3 structure

F2135-0884

CAS No.:1314-98-3
Molecular Weight:97.474
Molecular Formula:C10H6CLFN2O2 (isomer)
Names and Identifiers
Synonyms

6-(5-amino-3-methyl-1h-pyrazol-1-yl)-1-(4-chlorophenyl)-1h-pyrazolo[3,4-d]pyrimidin-4(5h)-one AKOS024627424 MCULE-1131066601 MOLPORT-009-688-833 ZINC35587882

Inchi
InChI=1/S.Zn/rSZn/c1-2
InChkey
WGPCGCOKHWGKJJ-UHFFFAOYSA-N
Canonical Smiles
S=[Zn]
Properties
Melting Point
1700°C
Vapour
12600mmHg at 25°C
HS Code
28309085
Safety and Handling
Risk Statements
R31
Safety Statements
50A
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 100000_1000000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
Du Pont Ibérica S.L. 2016
Eurecat Deutschland GmbH 2012
Freeport Cobalt Oy 2013
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:97.474g/mol
  • Molecular Formula:C10H6CLFN2O2
  • Exact Mass:95.901217
  • Monoisotopic Mass:95.901217
  • Complexity:2
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:32.1
  • Heavy Atom Count:2
  • 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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