Carbonic acid,1-methyl-1-(1-methyl-2-nitro-1H-imidazol-5-yl)ethyl phenyl ester

Modify Date: 2025-09-26 08:32:07

Carbonic acid,1-methyl-1-(1-methyl-2-nitro-1H-imidazol-5-yl)ethyl phenyl ester structure	Common Name	Carbonic acid,1-methyl-1-(1-methyl-2-nitro-1H-imidazol-5-yl)ethyl phenyl ester
	CAS Number	64323-88-2	Molecular Weight	305.28600
	Density	1.29g/cm3	Boiling Point	501.2ºC at 760mmHg
	Molecular Formula	C₁₄H₁₅N₃O₅	Melting Point	N/A
	MSDS	N/A	Flash Point	256.9ºC

Name	2-(3-methyl-2-nitroimidazol-4-yl)propan-2-yl phenyl carbonate

Density	1.29g/cm3
Boiling Point	501.2ºC at 760mmHg
Molecular Formula	C₁₄H₁₅N₃O₅
Molecular Weight	305.28600
Flash Point	256.9ºC
Exact Mass	305.10100
PSA	99.17000
LogP	3.30220
Index of Refraction	1.58
InChIKey	KUOKVKLNRUSHGT-UHFFFAOYSA-N
SMILES	Cn1c(C(C)(C)OC(=O)Oc2ccccc2)cnc1[N+](=O)[O-]

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI6815000

CHEMICAL NAME :: Imidazole-5-methanol, 2-nitro-alpha,alpha-1-trimethyl-, 5-phenylcarbonate

CAS REGISTRY NUMBER :: 64323-88-2

BEILSTEIN REFERENCE NO. :: 0896205

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H15-N3-O5

MOLECULAR WEIGHT :: 305.32

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 :: 3250 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - tremor Behavioral - ataxia

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: 21,781,1978

HS Code	2933290090

Phenyl chloroformate structure

Phenyl chloroformate

CAS#:1885-14-9

2-Nitro-.alpha.,.alpha.,1-trimethylimidazole-5-methanol structure

2-Nitro-.alpha....

CAS#:60628-92-4

~%

Carbonic acid,1-methyl-1-(1-methyl-2-nitro-1H-imidazol-5-yl)ethyl phenyl ester Structure

Carbonic acid,1...

CAS#:64323-88-2

Literature: Gruppo Lepetit S.p.A. Patent: US4113953 A1, 1978 ;

Precursor 2
CAS#:1885-14-9 Phenyl chloroformate CAS#:60628-92-4 2-Nitro-.alpha....
DownStream 0

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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