Ethanone,1-(2,5-dimethyl-1H-pyrrol-3-yl)-

Modify Date: 2024-01-09 14:30:51

Ethanone,1-(2,5-dimethyl-1H-pyrrol-3-yl)- Structure
Ethanone,1-(2,5-dimethyl-1H-pyrrol-3-yl)- structure
Common Name Ethanone,1-(2,5-dimethyl-1H-pyrrol-3-yl)-
CAS Number 1500-94-3 Molecular Weight 137.17900
Density 1.04g/cm3 Boiling Point 250.9ºC at 760mmHg
Molecular Formula C8H11NO Melting Point N/A
MSDS N/A Flash Point 112.1ºC

 Names

Name Ketone, 2,5-dimethyl-3-pyrrolyl methyl
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.04g/cm3
Boiling Point 250.9ºC at 760mmHg
Molecular Formula C8H11NO
Molecular Weight 137.17900
Flash Point 112.1ºC
Exact Mass 137.08400
PSA 32.86000
LogP 1.83410
Vapour Pressure 0.0136mmHg at 25°C
Index of Refraction 1.524

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OB2887000
CHEMICAL NAME :
Ketone, 2,5-dimethylpyrrol-3-yl methyl
CAS REGISTRY NUMBER :
1500-94-3
BEILSTEIN REFERENCE NO. :
0112096
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H11-N-O
MOLECULAR WEIGHT :
137.20
WISWESSER LINE NOTATION :
T5MJ B1 CV1 E1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
225 mg/kg
TOXIC EFFECTS :
Behavioral - anticonvulsant 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
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
553 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

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%

 Synonyms

3-acetyl-2,5-dimethylpyrrole
2,5-Dimethylpyrrol-3-yl-methylketon
Acetyl-3-dimethyl-2,5-pyrrol
2,5-dimethyl-3-acetylpyrrole
2,5-Dimethyl-3-acetyl-pyrrol