2,4-Dimethyl-3-ethyl-1H-pyrrole
Names
[ CAS No. ]:
517-22-6
[ Name ]:
2,4-Dimethyl-3-ethyl-1H-pyrrole
[Synonym ]:
MFCD00005222
Kryptopyrrole
Cryptopyrrole
EINECS 208-234-7
3-Ethyl-2,4-dimethyl-1H-pyrrole
2,4-Dimethyl-3-ethylpyrrole
3-Ethyl-2,4-diMethylpyrrole
Chemical & Physical Properties
[ Density]:
0.913 g/mL at 25 °C(lit.)
[ Boiling Point ]:
197 °C710 mm Hg(lit.)
[ Molecular Formula ]:
C8H13N
[ Molecular Weight ]:
123.19600
[ Flash Point ]:
161 °F
[ Exact Mass ]:
123.10500
[ PSA ]:
15.79000
[ LogP ]:
2.19390
[ Index of Refraction ]:
n20/D 1.496(lit.)
[ Storage condition ]:
0-6°C
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UX9629500
- CHEMICAL NAME :
- Pyrrole, 3-ethyl-2,4-dimethyl-
- CAS REGISTRY NUMBER :
- 517-22-6
- BEILSTEIN REFERENCE NO. :
- 0107089
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H13-N
- MOLECULAR WEIGHT :
- 123.22
- WISWESSER LINE NOTATION :
- T5MJ B1 C2 D1
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 :
- 77 mg/kg
- TOXIC EFFECTS :
- Brain and Coverings - recordings from specific areas of CNS Behavioral - somnolence (general depressed activity) Behavioral - changes in motor activity (specific assay)
- 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
[ Hazard Codes ]:
Xi:Irritant;
[ Risk Phrases ]:
R36/37/38
[ Safety Phrases ]:
S26-S36-S37/39
[ WGK Germany ]:
3
[ RTECS ]:
UX9629500
[ HS Code ]:
2933990090
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%