2-methyl-3-(4-nitrophenyl)-N-propan-2-yl-prop-2-enamide

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Names

[ CAS No. ]:
76691-34-4

[ Name ]:
2-methyl-3-(4-nitrophenyl)-N-propan-2-yl-prop-2-enamide

Chemical & Physical Properties

[ Density]:
1.158g/cm3

[ Boiling Point ]:
423.4ºC at 760 mmHg

[ Molecular Formula ]:
C13H16N2O3

[ Molecular Weight ]:
248.27800

[ Flash Point ]:
209.9ºC

[ Exact Mass ]:
248.11600

[ PSA ]:
74.92000

[ LogP ]:
3.43680

[ Index of Refraction ]:
1.573

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UC6400000
CHEMICAL NAME :
2-Propenamide, 2-methyl-N-(1-methylethyl)-3-(4-nitrophenyl)-
CAS REGISTRY NUMBER :
76691-34-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H16-N2-O3
MOLECULAR WEIGHT :
248.31

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 :
825 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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: 19,695,1980

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-methyl-3-(4-nitrophenyl)prop-2-enoyl chloride
  • isopropylamine

DownStream

Related Compounds

  • N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)-2-(4-isopropylphenoxy)acetamide
  • 2-(2-fluorophenoxy)-N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)acetamide
  • N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)-2-phenylacetamide
  • 2-(4-fluorophenyl)-N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)acetamide
  • N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)-2-(m-tolyl)acetamide
  • N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)-3-(4-methoxyphenyl)propanamide
  • (E)-N-(2-(2-(4-methoxyphenyl)ethynyl)benzylidene)-2-methylpropan-2-amine
  • Methyl (Z)-2-(2-aminothiazol-4-yl)pent-2-enoate
  • 1h-Indazole,1-acetyl-5-[4-(1-amino-1-methylethyl)phenyl]-
  • N-(1-(1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-methyl-1H-pyrazol-5-yl)-5-nitrofuran-2-carboxamide
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