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

Suppliers

Names

[ CAS No. ]:
1500-94-3

[ Name ]:
Ethanone,1-(2,5-dimethyl-1H-pyrrol-3-yl)-

[Synonym ]:
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

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

Precursor & DownStream

Precursor

  • 3-prop-2-ynylpentane-2,4-dione
  • 2,4-Pentandione
  • 3-ACETYL-2,5-DIMETHYLFURAN
  • 3-acetylhexane-2,5-dione
  • 2,5-Dimethypyrrole
  • diethoxy(methyl)carbenium tetrafluoroborate
  • Bromoethane

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

  • Ethanone, 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-(2-pyridinylthio)-
  • Ethanone, 1-(2-hydroxy-1,5-dimethyl-1H-pyrrol-3-yl)- (9CI)
  • Ethanone, 2-chloro-1-(2,5-dimethyl-1H-pyrrol-3-yl)- (9CI)
  • WAY-638924
  • WAY-621057
  • 1-[2,5-dimethyl-1-[(1R)-1-phenylethyl]pyrrol-3-yl]ethanone
  • 2,4-Dibromo-6-(difluoromethyl)-3-(trifluoromethyl)pyridine
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 6-methanesulfonyl-N-(8-methoxy-3-methylquinolin-4-yl)pyridine-3-sulfonamide
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4-ethyl-5-(3-methylbutyl)-4H-1,2,4-triazole-3-sulfonyl chloride
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde