Basic information Safety Supplier Related

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

Basic information Safety Supplier Related

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

Product Name:
Benz[cd]indol-2(1H)-one
Synonyms:
  • BENZO[CD]INDOL-2(1H)-ONE
  • BENZ[CD]INDOL-2(1H)-ONE
  • 2(1h)-perinaphthazolone
  • naphtholactam
  • 1,8-Naphthaolactam
  • Naphthostyril 1,8-Naphtholactam
  • 1,8-Naphthostyril
  • 2H-benzo[f]indol-2-one
CAS:
130-00-7
MF:
C11H7NO
MW:
169.18
EINECS:
204-973-4
Product Categories:
  • Building Blocks
  • C11
  • Fused Ring Systems
  • Building Blocks
  • Chemical Synthesis
  • Heterocyclic Building Blocks
  • Intermediates of Dyes and Pigments
  • Heterocyclic Building Blocks
  • Indoles
Mol File:
130-00-7.mol
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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)
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Safety Information

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.

MSDS

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

Uses

• ;Reactant in photo-Fries rearrangement1• ;Reactant in preparation of potential antitumor agents2• ;Reactant in synthesis of inhibitors of thymidylate synthase3

Uses

Benz[cd]indol-2(1H)-one was used in the synthesis of 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide analog, novel Mycobacterium protein tyrosine phosphatase B (mPTPB) inhibitor.

General Description

Benz[cd]indol-2(1H)-one is also referred as naphtholactam.

Benz[cd]indol-2(1H)-one Preparation Products And Raw materials

Preparation Products

Raw materials

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

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