5-Phenyl-pyrrole-2-acetic acid

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Names

[ CAS No. ]:
5449-90-1

[ Name ]:
5-Phenyl-pyrrole-2-acetic acid

[Synonym ]:
1h-pyrrole-2-acetic acid,5-phenyl
Pyrrole-2-acetic acid,5-phenyl
5-Phenyl-pyrrole-2-acetic acid

Chemical & Physical Properties

[ Molecular Formula ]:
C12H11NO2

[ Molecular Weight ]:
201.22100

[ Exact Mass ]:
201.07900

[ PSA ]:
53.09000

[ LogP ]:
2.30880

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UX9295000
CHEMICAL NAME :
Pyrrole-2-acetic acid, 5-phenyl-
CAS REGISTRY NUMBER :
5449-90-1
BEILSTEIN REFERENCE NO. :
0157785
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H11-N-O2
MOLECULAR WEIGHT :
201.24
WISWESSER LINE NOTATION :
T5MJ B1VQ ER

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 :
650 mg/kg
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Behavioral - somnolence (general depressed activity)
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1251,1968

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Phenyl-1H-pyrrole

DownStream

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-Phenyl-pyrrole-2-acetic acid hydrazide
  • 5-carboxy-3-(ethoxycarbonyl)-1-methyl-4-(2-phenylethyl)-1H-pyrrole-2-acetic acid, ethyl ester
  • 2,3-bis-acetoxymethyl-5-methyl-1-phenyl-pyrrole
  • 4-AMINO-6-PHENYLPYRIMIDINE
  • (4-acetamidophenyl) 2-[5-(4-methylbenzoyl)-1H-pyrrol-2-yl]acetate
  • 5-(Carboxymethyl)-2-methyl-1-phenyl-1H-pyrrole-3-carboxylic acid
  • N-[4-(2-aminopropanoyl)phenyl]acetamide
  • (3S)-3-(3,5-dichlorophenyl)-3-acetamidopropanoic acid
  • 3-amino-1-(1-methyl-2,3-dihydro-1H-indol-5-yl)propan-1-one
  • 7-Chlorothiazolo[4,5-b]pyridin-2-amine
  • 7-Methylthiazolo[4,5-b]pyridin-2-amine
  • (R)-2-Allylpyrrolidine
  • Thiazolo[4,5-b]pyridine,2-[(phenylmethyl)sulfonyl]-
  • 1-(6-(Piperidin-1-yl)pyridin-3-yl)ethan-1-ol
  • 4-(3-Bromo-5-fluorophenyl)butan-2-amine
  • 1,1,1-trifluoro-N-methyl-N-(piperidin-2-ylmethyl)methanamine
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