4-(6-Chloro-2H-1,4-benzoxazin-3-yl)benzeneacetic acid methyl ester

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Names

[ CAS No. ]:
86818-32-8

[ Name ]:
4-(6-Chloro-2H-1,4-benzoxazin-3-yl)benzeneacetic acid methyl ester

[Synonym ]:
Methyl 4-(6-chloro-2H-1,4-benzoxazine-3-yl)phenylacetate
4-(6-Chloro-2H-1,4-benzoxazin-3-yl)benzeneacetic acid methyl ester
Benzeneacetic acid,4-(6-chloro-2H-1,4-benzoxazin-3-yl)-,methyl ester

Chemical & Physical Properties

[ Density]:
1.29g/cm3

[ Boiling Point ]:
444.9ºC at 760 mmHg

[ Molecular Formula ]:
C17H14ClNO3

[ Molecular Weight ]:
315.75100

[ Flash Point ]:
222.8ºC

[ Exact Mass ]:
315.06600

[ PSA ]:
47.89000

[ LogP ]:
3.00430

[ Index of Refraction ]:
1.607

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CY1576205
CHEMICAL NAME :
Benzeneacetic acid, 4-(6-chloro-2H-1,4-benzoxazin-3-yl)-, methyl ester
CAS REGISTRY NUMBER :
86818-32-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H14-Cl-N-O3
MOLECULAR WEIGHT :
315.77

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 :
>1 gm/kg
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Behavioral - somnolence (general depressed activity) Kidney, Ureter, Bladder - urine volume increased
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: 22,297,1983

Synthetic Route


Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-(3,3,3-Trifluoropropanamido)propanoic acid
  • 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
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide