Indole-3-pyrubate

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Names

[ CAS No. ]:
392-12-1

[ Name ]:
Indole-3-pyrubate

[Synonym ]:
MFCD00005640
1H-Indole-3-propanoic acid, α-oxo-
3-(1H-Indol-3-yl)-2-oxopropanoic acid
Indole pyruvic acid
EINECS 206-874-1
Indole-3-pyrubate
Indole-3-pyruvic acid
INDOLE-3-PYRUVATE

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
445.2±28.0 °C at 760 mmHg

[ Melting Point ]:
215 °C (dec.)(lit.)

[ Molecular Formula ]:
C11H9NO3

[ Molecular Weight ]:
203.194

[ Flash Point ]:
223.0±24.0 °C

[ Exact Mass ]:
203.058243

[ PSA ]:
70.16000

[ LogP ]:
0.46

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

[ Index of Refraction ]:
1.685

[ Storage condition ]:
2-8°C

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NM1880000
CHEMICAL NAME :
Indole-3-pyruvic acid
CAS REGISTRY NUMBER :
392-12-1
BEILSTEIN REFERENCE NO. :
0172966
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H9-N-O3
MOLECULAR WEIGHT :
203.21
WISWESSER LINE NOTATION :
T56 BMJ D1VVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
500 ug/plate
REFERENCE :
JNCIAM Journal of the National Cancer Institute. (Washington, DC) V.1-60, 1940-78. For publisher information, see JJIND8. Volume(issue)/page/year: 57,921,1976

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
NM1880000

[ HS Code ]:
2918300090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • L(-)-Tryptophan
  • 4-(1'H-indol-3'-ylmethylene)-2-methyl-5(4H)oxazolone
  • DL-Tryptophan
  • Tryptophan,N-(chloroacetyl)- (9CI)
  • 2-imino-3-(1H-indol-3-yl)propanoic acid
  • Methyl 2-(1H-indol-3-yl)acetate
  • D-tryptophan
  • 2-Ketoglutaric acid
  • indol-3-yl-pyruvic acid ethyl ester

DownStream

  • Indole-3-carboxaldehyde
  • 3-Indoleacetic acid
  • Pyruvic acid
  • D-tryptophan
  • L(-)-Tryptophan
  • DL-INDOLE-3-LACTIC ACID
  • 1H-Indole-3-carboxylic acid
  • Indole-3-acetamide
  • indole-3-glycolic acid
  • 3,4-bis(1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylic acid

Customs

[ HS Code ]: 2918300090

[ Summary ]:
2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

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J. Med. Chem. 52 , 2786-93, (2009)

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Nat. Chem. Biol. 9(4) , 244-6, (2013)

We identify an Arabidopsis pyridoxal-phosphate-dependent aminotransferase, VAS1, whose loss-of-function simultaneously increases amounts of the phytohormone auxin and the ethylene precursor 1-aminocyc...


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Related Compounds

  • Indole-3-carboxaldehyde
  • Indole-3-carbinol
  • indole-3-acetic acid, [2-14c]
  • Indole, 3-isopropyl-5-methyl- (8CI)
  • Indole-3-propionic acid,-alpha--mercapto-, DL- (8CI)
  • Indole-3-carboxylic acid, 1-(2-bromoethyl)-5-hydroxy-2-methyl-, ethyl ester
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4-(4,5-Dihydro-1,2-oxazol-3-yl)piperidine
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide