CAS 52329-60-9|Mebendazole-amine

Introduction:Basic information about CAS 52329-60-9|Mebendazole-amine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameMebendazole-amine
CAS Number52329-60-9Molecular Weight237.25700
Density1.351g/cm3Boiling Point504.5ºC at 760 mmHg
Molecular FormulaC14H11N3OMelting Point176-185°C
MSDSChineseUSAFlash Point258.9ºC
Symbol
GHS07
Signal WordWarning

Names

Name(2-amino-3H-benzimidazol-5-yl)-phenylmethanone
SynonymMore Synonyms

Mebendazole-amine BiologicalActivity

DescriptionMebendazole-amine is a metabolite of Mebendazole. Mebendazole is a broad-spectrum benzimidazole anti-helminthic drug[1].
Related CatalogResearch Areas >>Others
References

[1]. Majewsky M, et al. Systematic identification of suspected anthelmintic benzimidazole metabolites using LC-MS/MS. J Pharm Biomed Anal. 2018;151:151-158.

[2]. Pantziarka P, et al. Repurposing Drugs in Oncology (ReDO)-mebendazole as an anti-cancer agent. Ecancermedicalscience. 2014;8:443. Published 2014 Jul 10.

Chemical & Physical Properties

Density1.351g/cm3
Boiling Point504.5ºC at 760 mmHg
Melting Point176-185°C
Molecular FormulaC14H11N3O
Molecular Weight237.25700
Flash Point258.9ºC
Exact Mass237.09000
PSA72.50000
LogP2.30620
Index of Refraction1.738
InChIKeyGPMHHSJZGVOEFS-UHFFFAOYSA-N
SMILESNc1nc2ccc(C(=O)c3ccccc3)cc2[nH]1
Storage condition-20°C Freezer, Under Inert Atmosphere

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OB1085000
CHEMICAL NAME :
Ketone, 2-amino-6-benzimidazolyl phenyl
CAS REGISTRY NUMBER :
52329-60-9
LAST UPDATED :
199307
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C14-H11-N3-O
MOLECULAR WEIGHT :
237.28
WISWESSER LINE NOTATION :
T56 BM DNJ CZ GVR

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 :
450 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MPPBAB Meditsinskaya Parazitologiya i Parazitarnye Bolezni. Medical Parasitology and Parasitic Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1932- Volume(issue)/page/year: 48(4),29,1979
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
257 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MPPBAB Meditsinskaya Parazitologiya i Parazitarnye Bolezni. Medical Parasitology and Parasitic Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1932- Volume(issue)/page/year: 48(4),29,1979 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
755 mg/kg
SEX/DURATION :
female 8-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 31,505,1976

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302
Precautionary StatementsP301 + P312 + P330
Hazard CodesXn
Risk Phrases22
RIDADRNONH for all modes of transport
RTECSOB1085000
HS Code2933990090

Customs

HS Code2933990090
Summary2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Synonyms

Ketone,2-amino-5-benzimidazolyl phenyl
G-1029
Benzimidazole,2-amino-5-benzoyl
2-Amino-5-benzoyl-1H-benzimidazole
2-Amino-5-benzoylbenzimidazole
KETONE,2-AMINO-6-BENZIMIDAZOLYL PHENYL
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