Michler's ketone Structure

Michler's ketone

Chemical Properties

Melting point 174 -176 °C(lit.)
Boiling point 360 °C
Density  1.0208 (rough estimate)
bulk density 400kg/m3
refractive index  1.5486 (estimate)
Flash point 220 °C
storage temp.  Store below +30°C.
solubility  ethanol: 5 mg/mL, clear
form  Powder
pka 2.55±0.12(Predicted)
color  Blue to dark blue or gray
Water Solubility  400 mg/L (20 ºC)
Merck  14,6177
BRN  790733
Stability Stable. Combustible. Incompatible with strong oxidizing agents, strong reducing agents.
InChI 1S/C17H20N2O/c1-18(2)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)19(3)4/h5-12H,1-4H3
InChIKey VVBLNCFGVYUYGU-UHFFFAOYSA-N
SMILES CN(C)c1ccc(cc1)C(=O)c2ccc(cc2)N(C)C
Toxicology and Carcinogenesis Bioassay of Michler's Ketone for Possible Carcinogenicity (CASRN 90-94-8)
Substances of Very High Concern (SVHC) Candidate List 4,4'-bis(dimethylamino)benzophenone (Michler’s ketone) (90-94-8)
CAS DataBase Reference 90-94-8(CAS DataBase Reference)
EWG's Food Scores 4-7
FDA UNII 3Z2SN6B347
Proposition 65 List Michler's Ketone
IARC 2B (Vol. 99) 2010
NIST Chemistry Reference Methanone, bis[4-(dimethylamino)phenyl]-(90-94-8)
EPA Substance Registry System Michler's ketone (90-94-8)
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Corrosion (GHS05)Health Hazard (GHS08)
Signal wordDanger
Hazard statements H318-H341-H350
Precautionary statements P201-P280-P305+P351+P338+P310-P308+P313
Hazard Codes  T,Xi
Risk Statements  45-41-68-36/37/38
Safety Statements  53-45-36-26
RIDADR  2811
WGK Germany  3
RTECS  DJ0250000
Autoignition Temperature 480 °C
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  III
HS Code  29223990
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Carc. 1B
Eye Dam. 1
Muta. 2
Hazardous Substances Data 90-94-8(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: > 6400 mg/kg
NFPA 704:
0
2 0

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