CAS 527-73-1|2-Nitroimidazole

Introduction：Basic information about CAS 527-73-1|2-Nitroimidazole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. 2-Nitroimidazole BiologicalActivity
3. Chemical & Physical Properties
4. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
5. Safety Information
6. Customs
7. Articles24
8. Synonyms

Common Name	2-Nitroimidazole
CAS Number	527-73-1	Molecular Weight	113.075
Density	1.6±0.1 g/cm3	Boiling Point	373.6±25.0 °C at 760 mmHg
Molecular Formula	C₃H₃N₃O₂	Melting Point	287 °C (dec.)(lit.)
MSDS	ChineseUSA	Flash Point	179.7±23.2 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	2-nitroimidazole
Synonym	More Synonyms

2-Nitroimidazole BiologicalActivity

Description	Azomycin is an antibiotic which can be active against aerobic Gram-positive and Gram-negative bacteria.
Related Catalog	Signaling Pathways >>Anti-infection >>BacterialResearch Areas >>Infection
Target	Bacterial[1]
In Vitro	Azomycin is an antibiotic which can be active against aerobic Gram-positive and Gram-negative bacteria. It is found that Azomycin is also active against a variety of anaerobic bacteria[1].
References	[1]. Shoji JH, et al. Isolation of azomycin from Pseudomonas fluorescens. J Antibiot (Tokyo). 1989 Oct;42(10):1513-4.

Chemical & Physical Properties

Density	1.6±0.1 g/cm3
Boiling Point	373.6±25.0 °C at 760 mmHg
Melting Point	287 °C (dec.)(lit.)
Molecular Formula	C₃H₃N₃O₂
Molecular Weight	113.075
Flash Point	179.7±23.2 °C
Exact Mass	113.022530
PSA	74.50000
LogP	0.15
Vapour Pressure	0.0±0.8 mmHg at 25°C
Index of Refraction	1.612
InChIKey	YZEUHQHUFTYLPH-UHFFFAOYSA-N
SMILES	O=[N+]([O-])c1ncc[nH]1
Storage condition	Refrigerator
Water Solubility	insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI7875000

CHEMICAL NAME :: Imidazole, 2-nitro-

CAS REGISTRY NUMBER :: 527-73-1

BEILSTEIN REFERENCE NO. :: 0116444

LAST UPDATED :: 199701

DATA ITEMS CITED :: 9

MOLECULAR FORMULA :: C3-H3-N3-O2

MOLECULAR WEIGHT :: 113.09

WISWESSER LINE NOTATION :: T5M CNJ BNW

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 :: 316 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 :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 80 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 :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 316 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 :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 80 mg/kg

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

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Microorganism - not otherwise specified

DOSE/DURATION :: 1 mg/plate

REFERENCE :: JGAMA9 Journal of General and Applied Microbiology. (Microbiology Research Foundation, c/o Japan Academic Soc. Center Bldg., 2-4-16 Yayoi, Bunkyo-ku, Tokyo, 113, Japan) V.1- 1955- Volume(issue)/page/year: 11,129,1965 *** REVIEWS *** TOXICOLOGY REVIEW ADCMAZ Advances in Chemotherapy. (New York, NY) V.1-3, 1964-68. For publisher information, see AVPCAQ. Volume(issue)/page/year: 3,39,1968 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6614 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 1822 (estimated) No. of Female Employees: 272 (estimated)

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302-H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard Codes	Xn:Harmful
Risk Phrases	R22;R36/37/38
Safety Phrases	S26-S36
RIDADR	UN 2811 6.1/PG 3
WGK Germany	3
RTECS	NI7875000
Packaging Group	III
Hazard Class	6.1
HS Code	2933990090

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%

Articles24

A (99m)Tc-labeled misonidazole analogue: step toward a (99m)Tc-alternative to [18F]fluromisonidazole for detecting tumor hypoxia.

Cancer Biother. Radiopharm. 30(2) , 79-86, (2015)

The PET radiopharmaceutical [(18)F]Fluromisonidazole ([(18)F]FMISO) is presently the agent of choice for the clinical imaging of tumor hypoxia. Considering the logistic advantages of (99m)Tc and wider...

The synthesis and radiolabeling of 2-nitroimidazole derivatives of cyclam and their preclinical evaluation as positive markers of tumor hypoxia.

J. Nucl. Med. 43(6) , 837-50, (2002)

The cyclam ligand (1,4,8,11-tetraazacyclotetradecane) was condensed with various azomycin-containing synthons to produce chemical compounds that could chelate radioactive metals. It was expected that ...

The oxygen dependence of the reduction of nitroimidazoles in a radiolytic model system.

Int. J. Radiat. Oncol. Biol. Phys. 10(8) , 1323-6, (1984)

Radiation chemical reductions using eaq- and CO2- have been carried out in the presence of oxygen with metronidazole, p-nitroacetophenone, misonidazole and three other 2-nitroimidazoles. Low concentra...

Synonyms

2-Nitroimidazol

Azomycin

2-Nitro-1H-imidazole

MFCD00005185

2-Nitroimidazole

EINECS 208-425-5

1H-Imidazole, 2-nitro-

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