1-(2-chloroethyl)-2-methyl-5-nitro-imidazol

Modify Date: 2025-08-25 15:38:48

1-(2-chloroethyl)-2-methyl-5-nitro-imidazol structure	Common Name	1-(2-chloroethyl)-2-methyl-5-nitro-imidazol
	CAS Number	13182-81-5	Molecular Weight	189.60000
	Density	1.45g/cm3	Boiling Point	364.8ºC at 760 mmHg
	Molecular Formula	C₆H₈ClN₃O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	174.4ºC

Name	1-(2-chloroethyl)-2-methyl-5-nitroimidazole
Synonym	More Synonyms

Density	1.45g/cm3
Boiling Point	364.8ºC at 760 mmHg
Molecular Formula	C₆H₈ClN₃O₂
Molecular Weight	189.60000
Flash Point	174.4ºC
Exact Mass	189.03100
PSA	63.64000
LogP	1.86170
Vapour Pressure	3.44E-05mmHg at 25°C
Index of Refraction	1.604

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI4389000

CHEMICAL NAME :: Imidazole, 1-(2-chloroethyl)-2-methyl-5-nitro-

CAS REGISTRY NUMBER :: 13182-81-5

BEILSTEIN REFERENCE NO. :: 0611685

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C6-H8-Cl-N3-O2

MOLECULAR WEIGHT :: 189.62

WISWESSER LINE NOTATION :: T5N CNJ A2G B1 ENW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1 gm/kg

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

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,167,1968

HS Code	2933290090

Metronidazole

CAS#:443-48-1

~92%

1-(2-chloroethy...

CAS#:13182-81-5

Literature: Alcalde; Manos; Valls; Elguero Journal of Heterocyclic Chemistry, 1984 , vol. 21, # 6 p. 1647 - 1651

ethyl 2-bromoacetate

CAS#:105-36-2

1-(2-chloroethy...

CAS#:13182-81-5

Literature: US2004/29898 A1, ;

Precursor 2
CAS#:443-48-1 Metronidazole CAS#:105-36-2 ethyl 2-bromoacetate
DownStream 5
CAS#:28997-31-1 N-[2-(2-methyl-... CAS#:16156-90-4 1-(2-Iodoethyl)... CAS#:96515-29-6 1-[2-(2-methyl-... CAS#:96515-32-1 2-methyl-1-[2-(...
CAS#:5712-49-2 sodium,4-methyl...

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%

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1-(2-chloroethyl)-2-methyl-5-nitro-imidazol

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Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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Synthetic Route

Precursor & DownStream

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