5-Acetylindoline,1-(2,3-dihydro-1H-indol-5-yl)ethanone

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Names

[ CAS No. ]:
16078-34-5

[ Name ]:
5-Acetylindoline,1-(2,3-dihydro-1H-indol-5-yl)ethanone

[Synonym ]:
Ethanone, 1-(2,3-dihydro-1H-indol-5-yl)-
Indoline, 5-acetyl-
Ethanone, 1- (2,3-dihydro-1H-indol-5-yl)-
1-(2,3-Dihydro-1H-indol-5-yl)ethanone
5-Acetylindoline
Ketone, 5-indolinyl methyl
5-Acetylindoline,1-(2,3-dihydro-1H-indol-5-yl)ethanone

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
338.7±31.0 °C at 760 mmHg

[ Melting Point ]:
70.5-71 °C

[ Molecular Formula ]:
C10H11NO

[ Molecular Weight ]:
161.200

[ Flash Point ]:
156.2±25.0 °C

[ Exact Mass ]:
161.084061

[ PSA ]:
29.10000

[ LogP ]:
1.50

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.559

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OB4505000
CHEMICAL NAME :
Ketone, 5-indolinyl methyl
CAS REGISTRY NUMBER :
16078-34-5
BEILSTEIN REFERENCE NO. :
0131199
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H11-N-O
MOLECULAR WEIGHT :
161.22
WISWESSER LINE NOTATION :
T56 BMT&J GV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02219

Safety Information

[ Hazard Codes ]:
Xi: Irritant;

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,3-DIHYDRO-4-(2-HYDROXYPHENYL)-2H-1,5-BENZODIAZEPIN-2-ONE
  • 1-Acetylindoline
  • Indoline
  • ethyl 2,3-dihydroindole-1-carboxylate
  • Acetyl chloride
  • 1H-Indole, 2,3-dihydro-1-(trifluoroacetyl)- (9CI)

DownStream

  • 5-(2-METHYL-1,3-THIAZOL-4-YL)INDOLINE
  • 1-(1H-Indol-5-yl)ethanone

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • (2S)-2-(3-methyl-2-nitrophenyl)oxirane
  • 2-(2-Methylfuran-3-yl)propanenitrile
  • 4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-{octahydropyrrolo[1,2-a]piperazin-2-yl}-5-oxopentanoic acid
  • 1-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclohexaneamido]cyclopentane-1-carboxylic acid
  • (2S)-2-{[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclohexyl]formamido}-3,3-dimethylbutanoic acid
  • (2S)-1-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylcyclohexanecarbonyl]pyrrolidine-2-carboxylic acid
  • 3-({4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]phenyl}formamido)-3-methylbutanoic acid
  • 3-{[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylphenyl]formamido}-3-methylbutanoic acid
  • 3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-phenylacetamido]-3-methylbutanoic acid
  • 3-[4-ethyl-6-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanamido]-3-methylbutanoic acid
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