1H-Indole-3-carboxylic acid

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Names

[ CAS No. ]:
771-50-6

[ Name ]:
1H-Indole-3-carboxylic acid

[Synonym ]:
3-Indolylcarboxylic acid
EINECS 212-231-6
Indole-3-carboxylic acid
Indole-3-carboxylicacid
1H-Indole-3-carboxylic acid
MFCD00005624
Indole-3-carboxylic_acid
3-Indoleformic acid
3-Indolecarboxylic acid

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
419.6±18.0 °C at 760 mmHg

[ Melting Point ]:
232-234 °C (dec.)(lit.)

[ Molecular Formula ]:
C9H7NO2

[ Molecular Weight ]:
161.157

[ Flash Point ]:
207.6±21.2 °C

[ Exact Mass ]:
161.047684

[ PSA ]:
53.09000

[ LogP ]:
1.99

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.726

[ Storage condition ]:
2-8°C

MSDS

Click to get detail MSDS

Safety Information

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

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R21/22;R36/37/38

[ Safety Phrases ]:
S22-S24/25-S36/37/39-S26

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
NK7882892

[ HS Code ]:
2942000000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Indole
  • Carbon dioxide
  • 3-Cyanoindole
  • 1-acetylindole-3-carboxylic acid
  • Ketone, indol-3-yl-trifluoromethyl-
  • Methyl 3-indolecarboxylate
  • Indole-3-carboxaldehyde
  • Potassium hydrogen carbonate
  • Trifluoroacetic anhydride
  • 1H-Indole-3-carboxaldehyde,oxime

DownStream

  • 1-Methyl-1H-indole-3-carboxylic acid
  • Methyl 3-indolecarboxylate
  • Methyl 1-methyl-1H-indole-3-carboxylate
  • 3-Indolinecarboxylic acid
  • Indole-3-carboxaldehyde
  • N-Methoxy-N-methyl-1H-indole-3-carboxamide
  • 1-Methylindole
  • 1H-indol-3-yl(piperidin-1-yl)methanone
  • Anthranilic acid
  • Indigo

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%

Articles

QSAR study on permeability of hydrophobic compounds with artificial membranes.

Bioorg. Med. Chem. 15 , 3756-67, (2007)

We previously reported a classical quantitative structure-activity relationship (QSAR) equation for permeability coefficients (P(app-pampa)) by parallel artificial membrane permeation assay (PAMPA) of...

Isolation and characterization of products from the nitrosation of the alkaloid gramine.

Food Chem. Toxicol. 23(9) , 841-7, (1985)

The nitrosation of gramine, a tertiary amine alkaloid present in barley malt, was carried out by reaction with sodium nitrite in buffered acetic acid (pH 3.4) for 1 hr at room temperature. Two major n...

Total synthesis of kottamide E.

Chem. Commun. (Camb.) 49(23) , 2296-8, (2013)

The first synthesis of kottamide E, a marine natural product containing a 5,6-dibromoindole linked via a (Z)-enamide to an unusual 1,2-dithiolane-containing amino acid, is reported.


More Articles

Related Compounds

  • 1H-Indole-3-carboxylic acid amide
  • 4-iodo-1H-indole-3-carboxylic acid
  • 5-Iodo-1H-indole-3-carboxylic acid
  • 4-bromo1H-indole-3-carboxylic acid
  • 4-cyano-1H-indole-3-carboxylic acid
  • 6-Cyano-1H-indole-3-carboxylic acid
  • 2-(methylamino)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide dihydrochloride
  • 3-(Ethylamino)pyrrolidin-2-one hydrochloride
  • Sodium 2-(4-cyanopyridin-2-yl)acetate
  • 2-(2-Methyl-4-oxo-3,4-dihydroquinazolin-3-yl)acetic acid hydrochloride
  • 1-methyl-3-(piperidin-3-yl)-1H-pyrazole-4-carboxamide hydrochloride
  • 9-fluoro-1H,2H,3H,4H,5H,10H-azepino[3,4-b]indole hydrochloride
  • 1-ethyl-5-(trifluoromethyl)-1H-pyrazol-4-amine hydrochloride
  • Lithium 2-(pyrazin-2-yl)acetate
  • 4-bromo-3-chloro-N-(pyridin-3-ylmethyl)aniline hydrochloride
  • 1-(5-Bromopyridin-3-yl)-4-ethylpiperazine dihydrochloride