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99451-55-5

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99451-55-5 Structure

99451-55-5 Structure
IdentificationBack Directory
[Name]

8-Bromo-5-(methylthio)[1,2,4]triazolo[4,3-c]pyrimidine
[CAS]

99451-55-5
[Synonyms]

EOS-61813
EED226 intermediate
8-Bromo-5-(methylthio)[1,2,4]triazolo[4,3-c]pyrimidine
1,2,4-TRIAZOLO[4,3-C]PYRIMIDINE, 8-BROMO-5-(METHYLTHIO)-
8-bromo-5-(methylsulfanyl)-[1,2,4]triazolo[4,3-c]pyrimidine
8-BROMO-5-(METHYLSULFANYL)-[1,2,4]TRIAZOLO[4,3-C]PYRIMIDINE(WX130489)
1,2,4-Triazolo[4,3-c]pyrimidine, 8-bromo-5-(methylthio)-1,2,4-Triazolo[4,3-c]pyrimidine, 8-bromo-5-(methylthio)-
[Molecular Formula]

C6H5BrN4S
[MDL Number]

MFCD28502491
[MOL File]

99451-55-5.mol
[Molecular Weight]

245.1
Chemical PropertiesBack Directory
[density ]

1.98±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

crystals
[pka]

-1.63±0.30(Predicted)
[color ]

Light yellow
[InChI]

InChI=1S/C6H5BrN4S/c1-12-6-8-2-4(7)5-10-9-3-11(5)6/h2-3H,1H3
[InChIKey]

PYXSQRIHTWWWIN-UHFFFAOYSA-N
[SMILES]

C1(SC)=NC=C(Br)C2=NN=CN12
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

8-Bromo-5-(methylthio)[1,2,4]triazolo[4,3-c]pyrimidine(99451-55-5)1HNMR
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