130-00-7

Name Benz[cd]indol-2(1H)-one
CAS 130-00-7
EINECS(EC#) 204-973-4
Molecular Formula C11H7NO
MDL Number MFCD00009748
Molecular Weight 169.18
MOL File 130-00-7.mol
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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
form  Powder
pka 13.27±0.20(Predicted)
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 130-00-7(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312+P330-P501
Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
Safety Statements 
WGK Germany  2
RTECS  DE3202000
TSCA  TSCA listed
REACH Registrations Inactive
HS Code  29337900
Storage Class 13 - Non Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
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.

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