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Thioflavin T Structure

Thioflavin T

  • Product NameThioflavin T
  • CAS2390-54-7
  • CBNumberCB6676791
  • MFC17H19ClN2S
  • MW318.86
  • EINECS219-228-9
  • MDL NumberMFCD00011944
  • MOL File2390-54-7.mol

Chemical Properties

Melting point: 211-212 °C (decomp)
Density  1.301g/cm3 at 20℃
vapor pressure  0Pa at 25℃
storage temp.  Store below +30°C.
solubility  methanol: soluble1mg/mL
Colour Index  49005
form  Powder
color  Yellow to ochre-yellow
Water Solubility  water: 5mg/mL
BRN  3922452
InChI InChI=1S/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1
InChIKey JADVWWSKYZXRGX-UHFFFAOYSA-M
SMILES C1(=[N+](C)C2C=CC(C)=CC=2S1)C1C=CC(N(C)C)=CC=1.[Cl-]
LogP 3.02 at 25℃ and pH7.98
CAS DataBase Reference 2390-54-7(CAS DataBase Reference)
EPA Substance Registry System Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, chloride (2390-54-7)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P261-P280-P305+P351+P338
Safety Statements  24/25
RIDADR  2811
WGK Germany  3
TSCA  TSCA listed
HazardClass  6.1(b)
PackingGroup  III
HS Code  3204130000
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
Skin Sens. 1
REACH Registrations Active
NFPA 704:
0
3 0

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