3-Nitrobenzenecarboximidamide

Modify Date: 2024-01-08 18:34:18

3-Nitrobenzenecarboximidamide Structure
3-Nitrobenzenecarboximidamide structure
Common Name 3-Nitrobenzenecarboximidamide
CAS Number 56406-50-9 Molecular Weight 165.149
Density 1.4±0.1 g/cm3 Boiling Point 301.7±44.0 °C at 760 mmHg
Molecular Formula C7H8ClN3O2 Melting Point 245-248ºC(lit.)
MSDS Chinese USA Flash Point 136.3±28.4 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 3-nitrobenzenecarboximidamide,hydrochloride
Synonym More Synonyms

 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

 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
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

~65%

3-Nitrobenzenecarboximidamide Structure

3-Nitrobenzenec...

CAS#:56406-50-9

Literature: Kuvaeva; Fedorova; Zaitsev; Yakovlev; Zakharov; Semakova Russian Journal of Organic Chemistry, 2012 , vol. 48, # 2 p. 209 - 213

~47%

3-Nitrobenzenecarboximidamide Structure

3-Nitrobenzenec...

CAS#:56406-50-9

Literature: Alonso-Alija, Cristina; Gielen, Heike; Hendrix, Martin; Niewohner, Ulrich; Schauss, Dagmar; Bischoff, Hilmar; Burkhardt, Nils; Geiss, Volker; Schlemmer, Karl-Heinz; Cuthbert, Nigel J.; Fitzgerald, Mary F.; Sturton, Graham Patent: US2003/139415 A1, 2003 ;

 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%

 Articles2

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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)

 Synonyms

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