Benz[cd]indol-2(1H)-one

Chemical Properties

Melting point	173-178 °C(lit.)
Boiling point	298.46°C (rough estimate)
Density	1.1616 (rough estimate)
vapor pressure	0.61-7.2Pa at 100-130℃
refractive index	1.4900 (estimate)
storage temp.	Sealed in dry,Room Temperature
solubility	methanol: soluble25mg/mL, clear to slightly hazy, yellow to brown
pka	13.27±0.20(Predicted)
form	Powder
color	Light orange to Yellow to Green
InChI	InChI=1S/C11H7NO/c13-11-8-5-1-3-7-4-2-6-9(12-11)10(7)8/h1-6H,(H,12,13)
InChIKey	GPYLCFQEKPUWLD-UHFFFAOYSA-N
SMILES	N1C2=C3C(C=CC=C3C1=O)=CC=C2
LogP	2.5 at 24℃ and pH6.6
CAS DataBase Reference	130-00-7(CAS DataBase Reference)
EPA Substance Registry System	Benz[cd]indol-2(1H)-one (130-00-7)

Hazard Codes	Xn
Risk Statements	22
Safety Statements	24/25
WGK Germany	2
RTECS	DE3202000
HS Code	29337900
Toxicity	mammal (species unspecified),LD50,oral,2700mg/kg (2700mg/kg),BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 82, 1986.