5-methoxyindole-2-carboxylic acid

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Names

[ CAS No. ]:
4382-54-1

[ Name ]:
5-methoxyindole-2-carboxylic acid

[Synonym ]:
5-methoxy-1H-indole-2-carboxylic acid
EINECS 224-487-6
MFCD00005614
5-methoxyindole-2-carboxylic acid

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
447.6±25.0 °C at 760 mmHg

[ Melting Point ]:
199-201 °C(lit.)

[ Molecular Formula ]:
C10H9NO3

[ Molecular Weight ]:
191.183

[ Flash Point ]:
224.5±23.2 °C

[ Exact Mass ]:
191.058243

[ PSA ]:
62.32000

[ LogP ]:
2.22

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.677

[ Storage condition ]:
Refrigerator

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL6005000
CHEMICAL NAME :
Indole-2-carboxylic acid, 5-methoxy-
CAS REGISTRY NUMBER :
4382-54-1
LAST UPDATED :
199109
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H9-N-O3
MOLECULAR WEIGHT :
191.20
WISWESSER LINE NOTATION :
T56 BMJ CVQ GO1

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 :
350 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 9,453,1974

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi

[ Safety Phrases ]:
S22-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
NL6005000

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Ethyl 5-methoxy-1H-indole-2-carboxylate
  • Methyl 5-methoxy-1H-indole-2-carboxylate
  • m-Anisaldehyde
  • p-Anisidine
  • 4-methoxybenzenediazonium,chloride
  • (E)-ETHYL 2-(2-(4-METHOXYPHENYL)HYDRAZONO)PROPANOATE
  • 3-(5-methoxy-2-nitro-phenyl)-2-oxo-propanoic acid

DownStream

  • Ethyl 3-formyl-5-methoxy-1H-indole-2-carboxylate
  • (5-Methoxy-1H-indol-2-yl)methanol
  • 5-Methoxy-1H-indole-2-carbaldehyde
  • 1H-Indole-2-carboxamide,5-methoxy-N,N-dimethyl-
  • (5-methoxy-1H-indol-2-yl)-(4-methylpiperazin-1-yl)methanone
  • Methyl 5-methoxy-1H-indole-2-carboxylate
  • 5-Methoxy-1H-indole-3-carbaldehyde
  • 5-Methoxyindole
  • 5-methoxy-1-(4-methoxyphenyl)sulfonylindole-3-carbaldehyde
  • 10-[5-methoxy-1-(4-methoxyphenyl)sulfonylindol-3-yl]decan-1-ol

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

  • 5-methoxyindole-2-carboxylic acid
  • 5-methoxyindole-2-carboxylic acid chloride
  • 1-methyl-5-methoxyindole-2-carboxylic acid
  • 6-hydroxy-5-methoxyindole-2-carboxylic acid
  • 5-Methoxyindole-2-carboxylic acid ethyl ester
  • 6-Benzyloxy-5-methoxyindole-2-carboxylic Acid