2-(trichloromethyl)-1H-benzimidazole

Modify Date: 2024-01-08 18:19:01

2-(trichloromethyl)-1H-benzimidazole Structure
2-(trichloromethyl)-1H-benzimidazole structure
 Common Name 2-(trichloromethyl)-1H-benzimidazole
CAS Number 3584-65-4 Molecular Weight 235.49800
Density 1.608 g/cm3 Boiling Point 346.9ºC at 760 mmHg
Molecular Formula C8H5Cl3N2 Melting Point N/A
MSDS N/A Flash Point 194.4ºC

 Names

Name 2-(trichloromethyl)-1H-benzimidazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.608 g/cm3
Boiling Point 346.9ºC at 760 mmHg
Molecular Formula C8H5Cl3N2
Molecular Weight 235.49800
Flash Point 194.4ºC
Exact Mass 233.95200
PSA 28.68000
LogP 3.38960
Index of Refraction 1.685

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE1125000
CHEMICAL NAME :
Benzimidazole, 2-trichloromethyl-
CAS REGISTRY NUMBER :
3584-65-4
BEILSTEIN REFERENCE NO. :
0958245
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H5-Cl3-N2
MOLECULAR WEIGHT :
235.50
WISWESSER LINE NOTATION :
T56 BM DNJ CXGGG

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 :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06786

 Safety Information

HS Code 2933990090

 Synthetic Route

o-Phenylenediamine structure

o-Phenylenediamine

CAS#:95-54-5
Methyl 2,2,2-trichloroacetimidate structure

Methyl 2,2,2-tr...

CAS#:2533-69-9

~95%

2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: Societe L'Oreal S.A. Patent: US6221343 B1, 2001 ;
Acetamide,2,2,2-trichloro-N-methyl- structure

Acetamide,2,2,2...

CAS#:23170-77-6
o-Phenylenediamine structure

o-Phenylenediamine

CAS#:95-54-5

~85%

2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: YALE UNIVERSITY; JORGENSEN, William; BUCALA, Richard, J. Patent: WO2010/21693 A2, 2010 ; Location in patent: Page/Page column 38-39 ;
Benzyl 2,2,2-trichloroacetimidate structure

Benzyl 2,2,2-tr...

CAS#:81927-55-1
o-Phenylenediamine structure

o-Phenylenediamine

CAS#:95-54-5

~90%

2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: AMGEN INC.; ALLEN, Jennifer R.; CHEN, Jian J.; FROHN, Michael J.; HU, Essa; LIU, Qingyian; PICKRELL, Alexander J.; RUMFELT, Shannon; RZASA, Robert M.; ZHONG, Wenge Patent: WO2011/143365 A1, 2011 ; Location in patent: Page/Page column 138 ; WO 2011/143365 A1
N-Boc-2-(2',2',2'-trichloroacetylamino)-aniline structure

N-Boc-2-(2',2',...

CAS#:1218786-38-9

~79%

2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: Porzelle, Achim; Woodrow, Michael D.; Tomkinson, Nicholas C.O. Organic Letters, 2010 , vol. 12, # 7 p. 1492 - 1495
2-Nitroaniline structure

2-Nitroaniline

CAS#:88-74-4

~%

2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: Lane, Charlotte A.L.; Hay, Duncan; Mowbray, Charles E.; Paradowski, Michael; Selby, Matthew D.; Swain, Nigel A.; Williams, David H. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 2 p. 1156 - 1159
o-Phenylenediamine structure

o-Phenylenediamine

CAS#:95-54-5
Methyl 2,2,2-trichloroacetimidate structure

Methyl 2,2,2-tr...

CAS#:2533-69-9

~%

2-(1H-benzimidazol-2-yl)-1H-benzimidazole structure

2-(1H-benzimida...

CAS#:6965-02-2
2-(trichloromethyl)-1H-benzimidazole Structure

2-(trichloromet...

CAS#:3584-65-4
Literature: Sinha, Hermant K.; Dogra, Sneh K. Bulletin of the Chemical Society of Japan, 1989 , vol. 62, # 8 p. 2668 - 2675

 Customs

HS Code 2933990090
Summary 2933990090. 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

2-trichloromethyl-1H-benzoimidazole
2-trichloromethyl-1H-benzimidazole
Benzimidazole,2-trichloromethyl
EINECS 222-712-2
2-Trichloromethylbenzimidazole
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