3-Nitrobenzenecarboximidamide

Names

[ Name ]:
3-Nitrobenzenecarboximidamide

[Synonym ]:
3-Nitrobenzenecarboximidamide
MFCD00012844
3-nitrobenzenecarboxamidine hydrochloride
3-nitrobenzamidinium chloride
3-nitrobenzenecarboximidamide hydrochloride
3-nitrobenzenecarboxamidine,chloride
m-nitrobenzamidine hydrochloride
Benzenecarboximidamide, 3-nitro-
EINECS 260-159-9
3-nitrobenzamidine hydrochloride
m-nitrobenzamidinium chloride

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
301.7±44.0 °C at 760 mmHg

[ Melting Point ]:
245-248ºC(lit.)

[ Molecular Formula ]:
C₇H₈ClN₃O₂

[ Molecular Weight ]:
165.149

[ Flash Point ]:
136.3±28.4 °C

[ Exact Mass ]:
165.053833

[ PSA ]:
95.69000

[ LogP ]:
0.72

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.642

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CV6295000

CHEMICAL NAME :: Benzamidine, m-nitro-, hydrochloride

CAS REGISTRY NUMBER :: 56406-50-9

LAST UPDATED :: 199206

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C7-H7-N3-O2.Cl-H

MOLECULAR WEIGHT :: 201.63

WISWESSER LINE NOTATION :: WNR CYZUM &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 :: 46500 ug/kg

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

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 84,16,1945

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332-H315-H319-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
CV6295000

[ HS Code ]:
2925290090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2925290090

[ Summary ]:
2925290090 other imines and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Articles

Structure-function dependence and allopurinol inhibition of radiosensitizer/nitroreductase interaction: approaches to improving therapeutic ratios.

Cancer Clin. Trials 3(1) , 55-62, (1980)

Normal tissue toxicity of nitroaromatic radiosensitizers may originate in radiosensitizer/nitroreductase interaction. A study of two mammalian cell nitroreductases, xanthine oxidase and NADH cytochrom...

Transformations of (Z)-2-benzoylamino-4-dimethylamino-2-oxo-3-butene and (E)-3-benzoylamino-4-cyano-2-oxo-3-butene into pyrimidine, pyrazole and isoxazole derivatives. Bratušek U, et al.

ARKIVOC 77 , 86, (2003)