Parsalmide

Modify Date: 2024-01-04 14:12:43

Parsalmide Structure
Parsalmide structure
 Common Name Parsalmide
CAS Number 30653-83-9 Molecular Weight 246.30500
Density 1.107g/cm3 Boiling Point 424ºC at 760mmHg
Molecular Formula C14H18N2O2 Melting Point N/A
MSDS N/A Flash Point 210.3ºC

 Names

Name Parsalmide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.107g/cm3
Boiling Point 424ºC at 760mmHg
Molecular Formula C14H18N2O2
Molecular Weight 246.30500
Flash Point 210.3ºC
Exact Mass 246.13700
PSA 64.35000
LogP 2.78280
Index of Refraction 1.558

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CU9060000
CHEMICAL NAME :
Benzamide, 5-amino-N-butyl-2-(2-propynyloxy)-
CAS REGISTRY NUMBER :
30653-83-9
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C14-H18-N2-O2
MOLECULAR WEIGHT :
246.34
WISWESSER LINE NOTATION :
4MVR CZ FO2UU1

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 :
864 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 115,145,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
428 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 115,145,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
148 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 115,145,1976

 Safety Information

HS Code 2924299090

 Synthetic Route

N-butyl-5-nitro-2-(2-propynyloxy)benzamide structure

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Fiorino, Ferdinando; Eiden, Martin; Giese, Armin; Severino, Beatrice; Esposito, Antonella; Groschup, Martin H.; Perissutti, Elisa; Magli, Elisa; Incisivo, Giuseppina Maria; Ciano, Antonio; Frecentese, Francesco; Kretzschmar, Hans A.; Wagner, Jens; Santagada, Vincenzo; Caliendo, Giuseppe Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 16 p. 5001 - 5011
5-acetamido-N-butyl-2-(prop-2-yn-1-yloxy)benzamide structure

5-acetamido-N-b...

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Caliendo, Giuseppe; Santagada, Vincenzo; Perissutti, Elisa; Severino, Beatrice; Fiorino, Ferdinando; Warner, Timothy D; Wallace, John L; Ifa, Demian Rocha; Antunes, Edson; Cirino, Giuseppe; De Nucci, Gilberto European Journal of Medicinal Chemistry, 2001 , vol. 36, # 6 p. 517 - 530
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5-Aminosalicyli...

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Caliendo, Giuseppe; Santagada, Vincenzo; Perissutti, Elisa; Severino, Beatrice; Fiorino, Ferdinando; Warner, Timothy D; Wallace, John L; Ifa, Demian Rocha; Antunes, Edson; Cirino, Giuseppe; De Nucci, Gilberto European Journal of Medicinal Chemistry, 2001 , vol. 36, # 6 p. 517 - 530
5-acetamido-N-butylsalicylamide structure

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Caliendo, Giuseppe; Santagada, Vincenzo; Perissutti, Elisa; Severino, Beatrice; Fiorino, Ferdinando; Warner, Timothy D; Wallace, John L; Ifa, Demian Rocha; Antunes, Edson; Cirino, Giuseppe; De Nucci, Gilberto European Journal of Medicinal Chemistry, 2001 , vol. 36, # 6 p. 517 - 530
N-Acetyl Mesalazine structure

N-Acetyl Mesalazine

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Caliendo, Giuseppe; Santagada, Vincenzo; Perissutti, Elisa; Severino, Beatrice; Fiorino, Ferdinando; Warner, Timothy D; Wallace, John L; Ifa, Demian Rocha; Antunes, Edson; Cirino, Giuseppe; De Nucci, Gilberto European Journal of Medicinal Chemistry, 2001 , vol. 36, # 6 p. 517 - 530
2-Chloro-5-nitrobenzoic acid structure

2-Chloro-5-nitr...

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Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Fiorino, Ferdinando; Eiden, Martin; Giese, Armin; Severino, Beatrice; Esposito, Antonella; Groschup, Martin H.; Perissutti, Elisa; Magli, Elisa; Incisivo, Giuseppina Maria; Ciano, Antonio; Frecentese, Francesco; Kretzschmar, Hans A.; Wagner, Jens; Santagada, Vincenzo; Caliendo, Giuseppe Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 16 p. 5001 - 5011
N-Butyl-2-chloro-5-nitrobenzamide structure

N-Butyl-2-chlor...

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~%

Parsalmide Structure

Parsalmide

CAS#:30653-83-9

Literature: Fiorino, Ferdinando; Eiden, Martin; Giese, Armin; Severino, Beatrice; Esposito, Antonella; Groschup, Martin H.; Perissutti, Elisa; Magli, Elisa; Incisivo, Giuseppina Maria; Ciano, Antonio; Frecentese, Francesco; Kretzschmar, Hans A.; Wagner, Jens; Santagada, Vincenzo; Caliendo, Giuseppe Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 16 p. 5001 - 5011

 Customs

HS Code 2924299090
Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

MY-41-6
5-amino-N-butyl-2-propargyloxybenzamide
Parsal
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