2-[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid

Names

[ CAS No. ]:
42866-02-4

[ Name ]:
2-[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid

Chemical & Physical Properties

[ Molecular Formula ]:
C16H19NO2

[ Molecular Weight ]:
257.32800

[ Exact Mass ]:
257.14200

[ PSA ]:
42.23000

[ LogP ]:
3.33800

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UX9278680
CHEMICAL NAME :
1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(3,5-dimethylphenyl)-
CAS REGISTRY NUMBER :
42866-02-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H19-N-O2
MOLECULAR WEIGHT :
257.36
WISWESSER LINE NOTATION :
T5NJ AR C1 E1& B1 C1VQ E1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2170 mg/kg
TOXIC EFFECTS :
Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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: 11,173,1976

Safety Information

[ HS Code ]:
2933990090

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-(difluoromethyl)-1-(1-hydroxypropan-2-yl)-1H-1,2,3-triazole-4-carboxamide
  • 1-{2,7-Diazaspiro[3.5]nonan-7-yl}-2-(dimethylamino)ethan-1-one
  • methyl (2E)-4-{2,7-diazaspiro[3.5]nonan-2-yl}-4-oxobut-2-enoate
  • [5-(1-methoxyethyl)-1-propyl-1H-1,2,3-triazol-4-yl]methanamine
  • 10-Methyl-6-oxa-2lambda6-thia-9-azaspiro[4.5]decane-2,2-dione
  • Tert-butyl 3-(3-hydroxy-1,1-dioxo-1lambda6-thiolan-3-yl)-3-(hydroxymethyl)pyrrolidine-1-carboxylate
  • 5-(4-Fluorophenyl)-1-oxa-4-azaspiro[5.5]undecane
  • 5-phenyl-N-propylpiperidine-3-carboxamide
  • 1-methyl-5-(2-methylbutyl)-1H-1,2,4-triazol-3-amine
  • 4-(3-iodo-1-methyl-1H-1,2,4-triazol-5-yl)butan-2-one
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