1H-Indole-1-aceticacid, 2,3-dihydro-2,3-dioxo-, ethyl ester

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Names

[ CAS No. ]:
41042-21-1

[ Name ]:
1H-Indole-1-aceticacid, 2,3-dihydro-2,3-dioxo-, ethyl ester

[Synonym ]:
2,3-Dioxo-1-indolineacetic acid ethyl ester
ethyl (2,3-dioxo-2,3-dihydroindol-1-yl)acetate
(2,3-dioxo-indolin-1-yl)-acetic acid ethyl ester
1-Indolineacetic acid,2,3-dioxo-,ethyl ester
ethyl 2-(2,3-dioxoindolin-1-yl)acetate
Ethyl (2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
(1-ethoxycarbonylmethyl)isatin
(2,3-dioxo-2,3-dihydro-indol-1-yl)acetic acid ethyl ester
INDOLINE-1-ACETIC ACID,2,3-DIOXO-,ETHYL ESTER
N-carbethoxymethylisatin

Chemical & Physical Properties

[ Density]:
1.32g/cm3

[ Boiling Point ]:
381.7ºC at 760mmHg

[ Molecular Formula ]:
C12H11NO4

[ Molecular Weight ]:
233.22000

[ Flash Point ]:
184.7ºC

[ Exact Mass ]:
233.06900

[ PSA ]:
63.68000

[ LogP ]:
0.84400

[ Index of Refraction ]:
1.57

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NM1891840
CHEMICAL NAME :
Indoline-1-acetic acid, 2,3-dioxo-, ethyl ester
CAS REGISTRY NUMBER :
41042-21-1
BEILSTEIN REFERENCE NO. :
0218567
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H11-N-O4
MOLECULAR WEIGHT :
233.24
WISWESSER LINE NOTATION :
T56 BNVVJ B1VO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
664 mg/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,858,1981

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • isatin
  • ethyl 2-bromoacetate
  • ethyl chloroacetate
  • 6-Fluoroindoline-2,3-dione
  • Na-salt of indoline-2,3-dion
  • Ethanol
  • (2,3-dioxo-indolin-1-yl)-acetyl chloride

DownStream

  • 1H-Indole-1-aceticacid, 2,3-dihydro-2,3-dioxo-
  • 2-Quinolinecarboxylicacid,3,4-dihydroxy-(9CI)

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

  • 1-(2-(3-((5-Chloropyrimidin-2-yl)oxy)pyrrolidin-1-yl)-2-oxoethyl)-3-(4-ethoxyphenyl)imidazolidin-2-one
  • 3-[(5-chloropyrimidin-2-yl)oxy]-N-(3,4-dichlorophenyl)pyrrolidine-1-carboxamide
  • 3-((5-chloropyrimidin-2-yl)oxy)-N-(4-fluorophenyl)pyrrolidine-1-carboxamide
  • 3-((5-chloropyrimidin-2-yl)oxy)-N-(3,4-dimethylphenyl)pyrrolidine-1-carboxamide
  • 3-((5-chloropyrimidin-2-yl)oxy)-N-(thiophen-2-ylmethyl)pyrrolidine-1-carboxamide
  • 3-((5-chloropyrimidin-2-yl)oxy)-N-(naphthalen-1-ylmethyl)pyrrolidine-1-carboxamide
  • 3-[5-(Difluoromethyl)-4-iodopyrazol-1-yl]propanoic acid
  • 3-((5-chloropyrimidin-2-yl)oxy)-N-(2-(trifluoromethyl)phenyl)pyrrolidine-1-carboxamide
  • N-benzhydryl-3-((5-chloropyrimidin-2-yl)oxy)pyrrolidine-1-carboxamide
  • 5-Chloro-2-((1-(ethylsulfonyl)pyrrolidin-3-yl)oxy)pyrimidine