5-acetyl-2,3-dihydro-1H-indol-2-one

HCID 10219643

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Basic information

CAS: 64483-69-8
Standard SMILES: CC(=O)c1ccc2c(c1)CC(=O)N2
InChIKey: HRMQSJQDTTZJPC-UHFFFAOYSA-N
Molecular formula: C10H9NO2
Average molar mass: 175.18 g/mol
Monoisotopic mass: 175.06332853

Names & identifiers

Preferred name: 5-acetyl-2,3-dihydro-1H-indol-2-one
IUPAC: 5-acetyl-1,3-dihydroindol-2-one
English name: 5-Acetyloxindole
Molecular formula: C10H9NO2
Molecular weight: 175.18

Names & synonyms

5-acetyl-2,3-dihydro-1H-indol-2-oneRefChem:531873846-866-05-ACETYLOXINDOLE64483-69-85-acetylindolin-2-one5-acetyl-1,3-dihydroindol-2-oneMFCD077820892H-Indol-2-one, 5-acetyl-1,3-dihydro-5-acetyl-2-indolinone2H-Indol-2-one,5-acetyl-1,3-dihydro-5-acetyl-1,3-dihydro-indol-2-one

Show more names

1H-indol-5-yl acetate

5-Acetyl-2-oxindole5-acetyl-1,3-dihydro-2H-indol-2-one5-acetyl-2-oxoindoline5-Acetyl-1H-indolin-2-oneSCHEMBL688076DTXSID00436865HRMQSJQDTTZJPC-UHFFFAOYSA-NSBB067219

Database identifiers

CAS: 64483-69-8
PubChem CID: 10219643
DTXSID: DTXSID00436865
EC Number: 846-866-0

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 46.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 249

Physicochemical properties

Melting point: 225 · 225-227 °C
Boiling point: 418.4 · 418.4±45.0 °C(Predicted)
Density: 1.228 · 1.228±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 13.46 · 13.46±0.20(Predicted)
Appearance: White to off-white Solid
CAS DataBase Reference: 64483 · 64483-69-8(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H317
Precautionary statements: 280 · P280
HS Code: 2933998090 · 2933998090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.