1-[5-bromo-2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanone

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Names

[ CAS No. ]:
79010-27-8

[ Name ]:
1-[5-bromo-2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanone

Chemical & Physical Properties

[ Density]:
1.337g/cm3

[ Boiling Point ]:
415.7ºC at 760 mmHg

[ Molecular Formula ]:
C14H18BrNO2

[ Molecular Weight ]:
312.20200

[ Flash Point ]:
205.2ºC

[ Exact Mass ]:
311.05200

[ PSA ]:
29.54000

[ LogP ]:
3.06420

[ Index of Refraction ]:
1.558

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5556700
CHEMICAL NAME :
Ethanone, 1-(5-bromo-2-(2-(1-pyrrolidinyl)ethoxy)phenyl)-
CAS REGISTRY NUMBER :
79010-27-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H18-Br-N-O2
MOLECULAR WEIGHT :
312.24

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 :
383 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Vascular - BP lowering not characterized in autonomic section
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 20,480,1981

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 5'-Bromo-2'-hydroxyacetophenone
  • 2-chloroethylpyrrolidine hydrochloride
  • 4-Bromophenol acetate

DownStream

Related Compounds

  • 1-[3-(Hydroxymethyl)azetidin-3-yl]-4-methylcyclohexan-1-ol
  • 3-[3-(Hydroxymethyl)azetidin-3-yl]-8-methyl-8-azabicyclo[3.2.1]octan-3-ol
  • 3-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]butanoic acid
  • Tert-butyl 3-[4-(dimethylcarbamoyl)phenyl]piperazine-1-carboxylate
  • tert-butyl N-[4-(2-amino-3,3,3-trifluoropropyl)-2-methoxyphenyl]carbamate
  • tert-butyl N-(3-{[1-(aminomethyl)cyclopropyl]methyl}-4-methoxyphenyl)carbamate
  • 3-[1-(Hydroxymethyl)cycloheptyl]azetidin-3-ol
  • 4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2H,3H,4H-pyrido[3,2-b][1,4]oxazine-7-carboxylic acid
  • 4-(oxan-4-yl)-N-(propan-2-yl)-1H-imidazol-2-amine
  • 2-(cyclopropylmethyl)-3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methylpentanamido]propanoic acid
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