methyl 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetate
Names
[ CAS No. ]:
1601-18-9
[ Name ]:
methyl 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetate
[Synonym ]:
Indomethacin derivative,5
EINECS 216-494-8
indomethacin methyl ester
Chemical & Physical Properties
[ Density]:
1.32g/cm3
[ Boiling Point ]:
499.4ºC at 760mmHg
[ Molecular Formula ]:
C20H18ClNO4
[ Molecular Weight ]:
371.81400
[ Flash Point ]:
255.8ºC
[ Exact Mass ]:
371.09200
[ PSA ]:
57.53000
[ LogP ]:
4.01570
[ Vapour Pressure ]:
9.13E-09mmHg at 25°C
[ Index of Refraction ]:
1.592
[ Storage condition ]:
2-8°C
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NL3522150
- CHEMICAL NAME :
- Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-, methyl ester
- CAS REGISTRY NUMBER :
- 1601-18-9
- BEILSTEIN REFERENCE NO. :
- 0496619
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C20-H18-Cl-N-O4
- MOLECULAR WEIGHT :
- 371.84
- WISWESSER LINE NOTATION :
- T56 BNJ BVR DG& C1 D1VO1 GO1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 40 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 114,309,1975
Safety Information
[ Hazard Codes ]:
Xi
[ HS Code ]:
2933990090
Synthetic Route
Precursor & DownStream
Precursor
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%