Alrestatin

Suppliers

Names

[ CAS No. ]:
51411-04-2

[ Name ]:
Alrestatin

[Synonym ]:
Alrestatine
2,3-Dioxopropyl dihydrogen phosphate
Propanal, 2-oxo-3-(phosphonooxy)-
alrestatin

Chemical & Physical Properties

[ Density]:
1.7±0.1 g/cm3

[ Boiling Point ]:
359.1±44.0 °C at 760 mmHg

[ Molecular Formula ]:
C14H9NO4

[ Molecular Weight ]:
168.042

[ Flash Point ]:
171.0±28.4 °C

[ Exact Mass ]:
167.982376

[ PSA ]:
76.37000

[ LogP ]:
-2.47

[ Vapour Pressure ]:
0.0±1.7 mmHg at 25°C

[ Index of Refraction ]:
1.480

[ Storage condition ]:
-20℃

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE4080500
CHEMICAL NAME :
1H-Benz(de)isoquinoline-2(3H)-acetic acid, 1,3-dioxo-
CAS REGISTRY NUMBER :
51411-04-2
BEILSTEIN REFERENCE NO. :
0244370
LAST UPDATED :
199703
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C14-H9-N-O4
MOLECULAR WEIGHT :
255.24

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 :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4405625
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1380 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4118495
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1220 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4118495

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,8-Naphthalic anhydride
  • Glycine
  • N-(carboethoxymethyl)-1,8-naphthalimide
  • methyl (1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-yl)acetate
  • 1,8-Naphthalimide
  • acetic acid

DownStream

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • ALRESTATIN SODIUM
  • N-[(2-bromo-4-fluorophenyl)methyl]cyclohexanamine
  • 4-bromo-N-(furan-2-ylmethyl)-2-methylaniline
  • 2-o-Tolyl-1H-quinolin-4-one
  • 2-(2-Aminoethoxy)acetaldehyde
  • 1-[2-Chloro-4-(trifluoromethyl)phenyl]guanidine
  • methyl 2-(2-phenylacetamido)-6-(propan-2-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate hydrochloride
  • N-(5,6-Dimethoxy-1,3-benzothiazol-2-YL)-N-[2-(dimethylamino)ethyl]naphthalene-2-carboxamide hydrochloride
  • N-[2-(Dimethylamino)ethyl]-N-(4-ethoxy-1,3-benzothiazol-2-YL)naphthalene-2-carboxamide hydrochloride
  • N-[2-(Dimethylamino)ethyl]-N-(6-methyl-1,3-benzothiazol-2-YL)naphthalene-2-carboxamide hydrochloride
  • (E)-N-(2-(dimethylamino)ethyl)-N-(6-ethoxybenzo[d]thiazol-2-yl)-3-(thiophen-2-yl)acrylamide hydrochloride
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