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Name	1-Acetyl-1H-indole-2,3-dione	EINECS	209-368-9
CAS No.	574-17-4	Density	1.413 g/cm³
PSA	54.45000	LogP	0.82740
Solubility	N/A	Melting Point	141-143°C
Formula	C10H7 N O3	Boiling Point	345.4 °C at 760 mmHg
Molecular Weight	189.17	Flash Point	165.8 °C
Transport Information	N/A	Appearance	N/A
Safety	22-24/25	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Indole-2,3-dione,1-acetyl- (7CI,8CI); Isatin, 1-acetyl- (6CI); 1-Acetyl-1H-indole-2,3-dione;1-Acetyl-2,3-dioxoindole; 1-Acetylindole-2,3-dione; 1-Acetylisatin;Acetylisatin; N-Acetylisatin; NSC 2761	Article Data	53

1-Acetyl-1H-indole-2,3-dione Chemical Properties

Molecular Structure of 1-Acetyl-1H-indole-2,3-dione (CAS No.574-17-4):

Molecular Formula: C₁₀H₇NO₃
Molecular Weight: 189.17
CAS No: 574-17-4
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 54.45 Å²
Index of Refraction: 1.617
Molar Refractivity: 46.84 cm³
Molar Volume: 133.8 cm³
Surface Tension: 61.2 dyne/cm
Density: 1.413 g/cm³
Flash Point: 165.8 °C
Enthalpy of Vaporization: 58.94 kJ/mol
Boiling Point: 345.4 °C at 760 mmHg
Vapour Pressure: 6.19E-05 mmHg at 25°C
IUPAC Name: 1-Acetylindole-2,3-dione
Canonical SMILES: CC(=O)N1C2=CC=CC=C2C(=O)C1=O
InChI: InChI=1S/C₁₀H₇NO₃/c1-6(12)11-8-5-3-2-4-7(8)9(13)10(11)14/h2-5H,1H3
InChIKey: LPGDEHBASRKTDG-UHFFFAOYSA-N
Classification Code: Drug/Therapeutic Agent
Product Categories: Indoles and derivatives;Indoline Oxindole

1-Acetyl-1H-indole-2,3-dione Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	809mg/kg (809mg/kg)	LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	Pharmaceutical Chemistry Journal Vol. 15, Pg. 858, 1981.
rat	LD	oral	> 500mg/kg (500mg/kg)		National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 22, 1953.

1-Acetyl-1H-indole-2,3-dione Safety Profile

Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
RTECS: NL7873800

1-Acetyl-1H-indole-2,3-dione Specification

1-Acetyl-1H-indole-2,3-dione (CAS No.574-17-4), it also can be called 1-Acetyl-2,3-indolinedione ; N-Acetylisatin .

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