1H-Imidazole-1-ethanol,a-(fluoromethyl)-2-nitro-

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Names

[ Name ]:
1H-Imidazole-1-ethanol,a-(fluoromethyl)-2-nitro-

[Synonym ]:
Fluoromisonidazole
1-(2-Hydroxy-3-fluoropropyl)-2-nitroimidazole
1-(2-Nitro-1-imidazolyl)-3-fluoro-2-propanol
Ro-07-0741
1-fluoro-3-(2-nitro-imidazol-1-yl)-propan-2-ol
SR 1367
SR 1369
KU 2210
1-(3-fluoro-2-hydroxypropyl)-2-nitroimidazole

Chemical & Physical Properties

[ Density]:
1.55 g/cm3

[ Boiling Point ]:
433.3ºC at 760 mmHg

[ Molecular Formula ]:
C₆H₈FN₃O₃

[ Molecular Weight ]:
189.14400

[ Flash Point ]:
215.8ºC

[ Exact Mass ]:
189.05500

[ PSA ]:
83.87000

[ LogP ]:
0.64490

[ Vapour Pressure ]:
2.82E-08mmHg at 25°C

[ Index of Refraction ]:
1.589

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI5566000

CHEMICAL NAME :: Imidazole-1-ethanol, alpha-(fluoromethyl)-2-nitro-

CAS REGISTRY NUMBER :: 13551-89-8

BEILSTEIN REFERENCE NO. :: 0522249

LAST UPDATED :: 199612

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C6-H8-F-N3-O3

MOLECULAR WEIGHT :: 189.17

WISWESSER LINE NOTATION :: T5N CNJ A1YQ1F BNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 620 mg/kg

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

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

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 900 mg/kg

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

MUTATION DATA

TYPE OF TEST :: Morphological transformation

TEST SYSTEM :: Rodent - mouse Embryo

DOSE/DURATION :: 1 mmol/L/3D (Continuous)

REFERENCE :: 45OJAG "Radiation Sensitizers: Their Use in the Clinical Management of Cancer, Proceedings of the Conference, Key Biscayne, FL, 1979," Brady, L.W., ed., New York, Masson Pub. USA, Inc., 1980 Volume(issue)/page/year: -,146,1980

Safety Information

[ HS Code ]:
2933290090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

2-Nitroimidazole
1-chloro-3-fluoro-2-propanol
Epifluorohydrin
2-nitro-1-(oxiran-2-ylmethyl)imidazole

DownStream

Customs

[ HS Code ]: 2933290090

[ Summary ]:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

1H-Imidazole-1-ethanol,a-(methoxymethyl)-2-nitro-, 1-acetate
1H-Imidazole-1-ethanol,a-[(diethylamino)methyl]-2-nitro-
1H-Imidazole-1-ethanol,a-(1-aziridinylmethyl)-2-nitro-
1H-Imidazole-1-ethanol,a-[(2-ethyl-1-aziridinyl)methyl]-2-nitro-
RB-6145
1H-Imidazole-1-ethanol,a-[[(2R,3R)-2,3-dimethyl-1-aziridinyl]methyl]-2-nitro-,rel-
N-(3-nitrophenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide
Propanamide, N-[2-[[2-hydroxy-3-[[4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl]oxy]propyl]amino]ethyl]-2-methyl-
N-(6-methoxybenzo[d]thiazol-2-yl)-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
Methyl 2-tetrahydropyranyloxypropionate
Methyl 4-(6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamido)benzoate
N-(3,4-dimethoxyphenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide
N-(2,4-dimethoxyphenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxo-1-[3-(trifluoromethyl)benzyl]-1,6-dihydropyridine-3-carboxamide
N-(4-fluoro-3-nitrophenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide
N-(2-methyl-4-nitrophenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide

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