Tomoxiprole

Modify Date: 2025-08-27 18:19:59

Tomoxiprole Structure
Tomoxiprole structure
 Common Name Tomoxiprole
CAS Number 76145-76-1 Molecular Weight 316.39600
Density 1.178g/cm3 Boiling Point 529.1ºC at 760 mmHg
Molecular Formula C21H20N2O Melting Point N/A
MSDS N/A Flash Point 186.5ºC

 Names

Name 2-(4-methoxyphenyl)-3-propan-2-ylbenzo[e]benzimidazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.178g/cm3
Boiling Point 529.1ºC at 760 mmHg
Molecular Formula C21H20N2O
Molecular Weight 316.39600
Flash Point 186.5ºC
Exact Mass 316.15800
PSA 27.05000
LogP 5.44600
Index of Refraction 1.666

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QK9343000
CHEMICAL NAME :
3H-Naphth(1,2-d)imidazole, 2-(4-methoxyphenyl)-3-(1-methylethyl)-
CAS REGISTRY NUMBER :
76145-76-1
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C21-H20-N2-O
MOLECULAR WEIGHT :
316.43
WISWESSER LINE NOTATION :
T B566 CN ENJ DR DO1& EY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
15 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJDPD2 European Journal of Drug Metabolism and Pharmacokinetics. (Medecine et Hygiene, POB 229, CH-1211 Geneva 4, Switzerland) V.1- 1976- Volume(issue)/page/year: 10,161,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,133,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,133,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,133,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,133,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,133,1985

 Safety Information

HS Code 2933990090

 Synthetic Route

1-nitroso-N-propan-2-ylnaphthalen-2-amine structure

1-nitroso-N-pro...

CAS#:76145-77-2

~%

Tomoxiprole Structure

Tomoxiprole

CAS#:76145-76-1

Literature: Toja; Selva; Schiatti Journal of Medicinal Chemistry, 1984 , vol. 27, # 5 p. 610 - 616
1-Nitroso-2-naphthol structure

1-Nitroso-2-naphthol

CAS#:131-91-9

~%

Tomoxiprole Structure

Tomoxiprole

CAS#:76145-76-1

Literature: Toja; Selva; Schiatti Journal of Medicinal Chemistry, 1984 , vol. 27, # 5 p. 610 - 616
1-Amino-2-isopropylaminonaphthalin structure

1-Amino-2-isopr...

CAS#:35624-23-8

~%

Tomoxiprole Structure

Tomoxiprole

CAS#:76145-76-1

Literature: Toja; Selva; Schiatti Journal of Medicinal Chemistry, 1984 , vol. 27, # 5 p. 610 - 616
4-Methoxybenzaldehyde structure

4-Methoxybenzal...

CAS#:123-11-5

~%

Tomoxiprole Structure

Tomoxiprole

CAS#:76145-76-1

Literature: Toja; Selva; Schiatti Journal of Medicinal Chemistry, 1984 , vol. 27, # 5 p. 610 - 616

 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

Tomoxiprolum
S085
3-(1-methylethyl)-2-(4-methoxyphenyl)-3H-naphth<1,2-d>imidazole
UNII-EZ948T2878
Tomoxiprole
MDL-035
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