1H-Imidazole-5-carboxylicacid, 1-(1-phenylethyl)-, methyl ester, hydrochloride (1:1)

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Names

[ CAS No. ]:
35944-74-2

[ Name ]:
1H-Imidazole-5-carboxylicacid, 1-(1-phenylethyl)-, methyl ester, hydrochloride (1:1)

Chemical & Physical Properties

[ Density]:
1.13g/cm3

[ Boiling Point ]:
379.4ºC at 760mmHg

[ Melting Point ]:
173-174°C

[ Molecular Formula ]:
C₁₃H₁₅ClN₂O₂

[ Molecular Weight ]:
266.72300

[ Flash Point ]:
183.2ºC

[ Exact Mass ]:
266.08200

[ PSA ]:
44.12000

[ LogP ]:
3.08100

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI4200000

CHEMICAL NAME :: Imidazole-5-carboxylic acid, 1-(alpha-methylbenzyl)-, methyl ester, hydrochloride

CAS REGISTRY NUMBER :: 35944-74-2

LAST UPDATED :: 199009

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C13-H14-N2-O2.Cl-H

MOLECULAR WEIGHT :: 266.75

WISWESSER LINE NOTATION :: T5N CNJ AY1&R& EVO1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 18 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#09250

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Bird - pigeon

DOSE/DURATION :: 42 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 21,315,1972

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Bird - duck

DOSE/DURATION :: 133 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 21,315,1972

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Bird - wild bird species

DOSE/DURATION :: 32 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 21,315,1972

Safety Information

[ Hazard Codes ]:
Xi

Related Compounds

5-[2-(Chloromethyl)-2-methylbut-3-en-1-yl]-1,2,3-thiadiazole
5-[2-(Chloromethyl)-3-methylbutyl]-1,2,3-thiadiazole
1-(4-Methylthiophen-3-yl)propan-2-ol
7-Bromo-3-ethyl-2-methylquinoline
2-Tert-butyl-7-iodo-4-methylquinoline
7-Iodo-4-methylquinoline-2-carboxylic acid
7-Iodo-4-methyl-2-(trifluoromethyl)quinoline
2-(Difluoromethyl)-7-iodo-4-methylquinoline
N-((Benzyl(methyl)(phenyl)silyl)methyl)-4-methylbenzenesulfonamide
Methyl 3H-[1,2,3]triazolo[4,5-c]pyridine-4-carboxylate

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