ibotenic acid monohydrate
Names
[ CAS No. ]:
60573-88-8
[ Name ]:
ibotenic acid monohydrate
[Synonym ]:
EINECS 218-853-4
2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid,hydrate
MFCD00150903
Chemical & Physical Properties
[ Density]:
1.621g/cm3
[ Melting Point ]:
148-151ºC
[ Molecular Formula ]:
C5H8N2O5
[ Molecular Weight ]:
176.12700
[ Exact Mass ]:
176.04300
[ PSA ]:
118.55000
[ Appearance of Characters ]:
Powder or Solid | White to off-white to light yellow
[ Index of Refraction ]:
1.588
[ Storage condition ]:
Freezer (-20°C)
[ Water Solubility ]:
NH4OH 1 M: 50 mg/mL, clear, colorless to yellow
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NY2100000
- CHEMICAL NAME :
- 5-Isoxazoleacetic acid, alpha-amino-3-hydroxy-, monohydrate
- CAS REGISTRY NUMBER :
- 60573-88-8
- LAST UPDATED :
- 199012
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C5-H6-N2-O4.H2-O
- MOLECULAR WEIGHT :
- 176.15
- WISWESSER LINE NOTATION :
- T5NOJ CYZVQ EQ &QH
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 :
- 129 mg/kg
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,311,1968
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 42 mg/kg
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,311,1968
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 38 mg/kg
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,311,1968
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 15 mg/kg
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,311,1968 *** REVIEWS *** TOXICOLOGY REVIEW LLOYA2 Lloydia. (Cincinnati, OH) V.1-41, 1938-78. For publisher information, see JNPRDF. Volume(issue)/page/year: 38,36,1975
Safety Information
[ Hazard Codes ]:
T
[ Risk Phrases ]:
25
[ Safety Phrases ]:
22-36/37/39-45
[ RIDADR ]:
UN 3462 6.1/PG 3
[ WGK Germany ]:
3
[ RTECS ]:
NY2100000
[ HS Code ]:
2934999090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2934999090
[ Summary ]:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%