3-[[(dimethylamino)methylene]amino]-3-(2,4,6-triiodophenyl)propionic acid
Names
[ CAS No. ]:
5587-89-3
[ Name ]:
3-[[(dimethylamino)methylene]amino]-3-(2,4,6-triiodophenyl)propionic acid
[Synonym ]:
oragrafin
Ipodic acid
Iopdate
bilopten
3-<2.4.6-Triiod-3-dimethylaminomethylenamino-phenyl>-propionsaeure
Ipodat-saeure
bilimin acid
Chemical & Physical Properties
[ Density]:
2.31g/cm3
[ Boiling Point ]:
579.8ºC at 760mmHg
[ Melting Point ]:
168-169ºC
[ Molecular Formula ]:
C12H13I3N2O2
[ Molecular Weight ]:
597.95700
[ Flash Point ]:
304.4ºC
[ Exact Mass ]:
597.81100
[ PSA ]:
52.90000
[ LogP ]:
3.73900
[ Index of Refraction ]:
1.715
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- MW5160000
- CHEMICAL NAME :
- Hydrocinnamic acid, 3-(((dimethylamino)methylene)amino)-2,4,6-triiodo-
- CAS REGISTRY NUMBER :
- 5587-89-3
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C12-H13-I3-N2-O2
- MOLECULAR WEIGHT :
- 597.97
- WISWESSER LINE NOTATION :
- QV2R BI DI FI CNU1N1&1
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 :
- 1030 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Blood - other changes
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,232,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 300 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Blood - other changes
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,232,1969
Safety Information
[ HS Code ]:
2925290090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2925290090
[ Summary ]:
2925290090 other imines and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%