5-ethyl-2,3-dihydro-1H-indole-2,3-dione

HCID 583487

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Basic information

CAS: 96202-56-1
Standard SMILES: CCc1ccc2c(c1)C(=O)C(=O)N2
InChIKey: XDGNFZUIJHZHHP-UHFFFAOYSA-N
Molecular formula: C10H9NO2
Average molar mass: 175.18 g/mol
Monoisotopic mass: 175.06332853

Names & identifiers

Preferred name: 5-ethyl-2,3-dihydro-1H-indole-2,3-dione
IUPAC: 5-ethyl-1H-indole-2,3-dione
English name: 5-Ethyl-1H-indole-2,3-dione
Molecular formula: C10H9NO2
Molecular weight: 175.18

Names & synonyms

5-ethyl-2,3-dihydro-1H-indole-2,3-dioneRefChem:535487860-408-75-Ethyl-1H-indole-2,3-dione96202-56-15-ethylindoline-2,3-dione1H-Indole-2,3-dione, 5-ethyl-5-ethylisatinMFCD01132047Cambridge id 5710131SCHEMBL2246979DTXSID70342641

Show more names

5-Ethylisatin5-Ethyl-1H-indole-2,3-dione

5-Ethyl-1H-indole-2,3-dione #ALBB-002984STK215193AKOS000200943SB645275-ethyl-1H-benzo[d]azoline-2,3-dioneBS-13736ST088205

Database identifiers

CAS: 96202-56-1
PubChem CID: 583487
DTXSID: DTXSID70342641
EC Number: 860-408-7
Nikkaji: J1.079.011E

Properties

Computed structural properties

XLogP: 1.6
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

Density: 1.247 · 1.247±0.06 g/cm3(Predicted)
storage temp.: Store at room temperature
pka: 9.86 · 9.86±0.20(Predicted)
Appearance: Yellow to orange Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H315-H302-H319
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H335-H315-H302-H319
Precautionary statements: P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362