1H-Pyrrole-3-carboxylicacid, 5-acetyl-2,4-dimethyl-, ethyl ester

Names

[ Name ]:
1H-Pyrrole-3-carboxylicacid, 5-acetyl-2,4-dimethyl-, ethyl ester

[Synonym ]:
PYRROLE-3-CARBOXYLIC ACID,5-ACETYL-2,4-DIMETHYL-,ETHYL ESTER
2,4-Dimethyl-5-acetyl-pyrrol-carbonsaeure-(3)-ethylester
5-Acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
3,5-Dimethyl-2-acetyl-4-ethoxycarbonyl-pyrrol
5-Acetyl-2,4-dimethyl-pyrrol-3-carbonsaeure-aethylester
5-Acetyl-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester

Chemical & Physical Properties

[ Density]:
1.123g/cm3

[ Boiling Point ]:
379.6ºC at 760 mmHg

[ Molecular Formula ]:
C₁₁H₁₅NO₃

[ Molecular Weight ]:
209.24200

[ Flash Point ]:
183.4ºC

[ Exact Mass ]:
209.10500

[ PSA ]:
59.16000

[ LogP ]:
2.01080

[ Index of Refraction ]:
1.521

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UX9371100

CHEMICAL NAME :: Pyrrole-3-carboxylic acid, 5-acetyl-2,4-dimethyl-, ethyl ester

CAS REGISTRY NUMBER :: 6314-22-3

BEILSTEIN REFERENCE NO. :: 0160846

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H15-N-O3

MOLECULAR WEIGHT :: 209.27

WISWESSER LINE NOTATION :: T5MJ BV1 C1 DVO2 E1

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

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%