Isoxepac

Suppliers

Names

[ CAS No. ]:
55453-87-7

[ Name ]:
Isoxepac

[Synonym ]:
6,11-dihydro-11-oxo-dibenz[b,e]oxepin-2-acetic acid
Dibenz[b,e]oxepin-2-acetic acid, 6,11-dihydro-11-oxo-
Isoxepac
MFCD00242952
(11-Oxo-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid
Artil

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
528.2±50.0 °C at 760 mmHg

[ Melting Point ]:
130-132ºC

[ Molecular Formula ]:
C16H12O4

[ Molecular Weight ]:
268.264

[ Flash Point ]:
203.8±23.6 °C

[ Exact Mass ]:
268.073547

[ PSA ]:
63.60000

[ LogP ]:
2.64

[ Vapour Pressure ]:
0.0±1.5 mmHg at 25°C

[ Index of Refraction ]:
1.636

[ Storage condition ]:
Refrigerator

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HQ4110000
CHEMICAL NAME :
Dibenz(b,e)oxepin-2-acetic acid, 6,11-dihydro-11-oxo-
CAS REGISTRY NUMBER :
55453-87-7
BEILSTEIN REFERENCE NO. :
1320243
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C16-H12-O4
MOLECULAR WEIGHT :
268.28
WISWESSER LINE NOTATION :
T C676 BV IO JHJ E1VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
143 mg/kg
TOXIC EFFECTS :
Gastrointestinal - ulceration or bleeding from stomach Gastrointestinal - ulceration or bleeding from small intestine
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 227,142,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Gastrointestinal - ulceration or bleeding from stomach Gastrointestinal - ulceration or bleeding from small intestine
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 227,142,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
240 mg/kg
TOXIC EFFECTS :
Gastrointestinal - ulceration or bleeding from stomach Gastrointestinal - ulceration or bleeding from small intestine
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 227,142,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
160 mg/kg
TOXIC EFFECTS :
Gastrointestinal - ulceration or bleeding from stomach Gastrointestinal - ulceration or bleeding from small intestine
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 227,142,1977

Safety Information

[ Hazard Codes ]:
T

[ Risk Phrases ]:
25-62

[ Safety Phrases ]:
36/37-45

[ HS Code ]:
2942000000

Synthetic Route

Precursor & DownStream

Precursor

  • Acetic 2-(phenoxymethyl)benzoic anhydride
  • Methyl 2-bromomethylbenzoate
  • Ethyl 2-(4-hydroxyphenyl)acetate
  • 4-Hydroxyphenylacetic acid
  • Phthalide

DownStream

  • 6,11-Dihydro-11-oxo-dibenz[b,e]oxepin-2-acetate,methyl ester
  • Olopatadine Hydrochloride

Customs

[ HS Code ]: 2932999099

[ Summary ]:
2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%


Related Compounds

  • Isoxepac-d6
  • isoxepac glucuronide
  • N-(3-(dimethylamino)propyl)-2-fluoro-N-(6-fluorobenzo[d]thiazol-2-yl)benzamide hydrochloride
  • N-(3-(dimethylamino)propyl)-4-ethoxy-N-(6-fluorobenzo[d]thiazol-2-yl)benzamide hydrochloride
  • N-(3-(dimethylamino)propyl)-2-(2,5-dioxopyrrolidin-1-yl)-N-(6-fluorobenzo[d]thiazol-2-yl)acetamide hydrochloride
  • N-(3-(dimethylamino)propyl)-N-(6-fluorobenzo[d]thiazol-2-yl)-2-phenylacetamide hydrochloride
  • 2-Methylpropanecarbonyl isocyanate
  • 1-Cyclopentylbut-3-en-2-ol
  • 1-Ethyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-methanamine
  • 7-{4-[(Benzyloxy)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
  • 5-chloro-2-(4-methyl-1H-pyrazol-1-yl)aniline
  • (1R,2R)-N,2-Dimethyl-1-{[(pyridin-3-yl)oxy]methyl}cyclopropan-1-amine
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