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7697-46-3

7697-46-3 structure
7697-46-3 structure
  • Name: 2-Benzoylpyrrole
  • Chemical Name: 2-Benzoylpyrrole
  • CAS Number: 7697-46-3
  • Molecular Formula: C11H9NO
  • Molecular Weight: 171.19500
  • Create Date: 2018-09-03 12:31:31
  • Modify Date: 2024-01-03 15:06:18

Name 2-Benzoylpyrrole
Synonyms phenyl-pyrrol-2-yl-methanone
Pyrrol-2-yl Phenyl Ketone
2-Benzoylpyrroline
2-Benzoyl-1H-pyrrole
Phenyl-pyrrol-2-yl-keton
Density 1.173 g/cm3
Boiling Point 305.7ºC at 760 mmHg
Melting Point 75-77ºC
Molecular Formula C11H9NO
Molecular Weight 171.19500
Flash Point 146.6ºC
Exact Mass 171.06800
PSA 32.86000
LogP 2.24570
Index of Refraction 1.608

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OB6407000
CHEMICAL NAME :
Ketone, phenyl pyrrol-2-yl
CAS REGISTRY NUMBER :
7697-46-3
BEILSTEIN REFERENCE NO. :
0120606
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H9-N-O
MOLECULAR WEIGHT :
171.21
WISWESSER LINE NOTATION :
T5MJ BVR

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 :
750 mg/kg
TOXIC EFFECTS :
Behavioral - sleep 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 :
767 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