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4171-13-5

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Basic Information
CAS No.: 4171-13-5
Name: valnoctamide
Article Data: 6
Molecular Structure:
Molecular Structure of 4171-13-5 (valnoctamide)
Formula: C8H17 N O
Molecular Weight: 143.229
Synonyms: Valeramide,2-ethyl-3-methyl- (6CI,7CI,8CI); 2-Ethyl-3-methylvaleramide; Axiquel; McN X181; NSC 32363; NSC 34092; Nirvanil; Valmethamide; Valnoctamide
EINECS: 224-033-7
Density: 0.883g/cm3
Melting Point: 113.5-1140C
Boiling Point: 274.4°Cat760mmHg
Flash Point: 119.8°C
Solubility: 8.70g/L(temperature not stated)
Hazard Symbols: Xn
Risk Codes: 22
Safety: Moderately toxic by ingestion and intraperitoneal routes. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx.
PSA: 43.09000
LogP: 2.24430
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Chemistry

Empirical Formula: C8H17NO
Molecular Weight: 143.2267 g/mol
EINECS: 224-033-7 
Index of Refraction: 1.438
Density: 0.883 g/cm3
Flash Point: 119.8 °C 
Melting point: 113.5-114 °C
Appearance: Crystalline solid
Enthalpy of Vaporization: 51.28 kJ/mol
Boiling Point: 274.4 °C at 760 mmHg
Vapour Pressure: 0.00541 mmHg at 25 °C 
Structure of 2-Ethyl-3-methylpentanamide (CAS NO.4171-13-5):
            
IUPAC Name: 2-Ethyl-3-methylpentanamide
Product Categories of 2-Ethyl-3-methylpentanamide (CAS NO.4171-13-5): Intermediates & Fine Chemicals;Pharmaceuticals
 

Uses

  2-Ethyl-3-methylpentanamide (CAS NO.4171-13-5) can be used for isomer of Valpromide.

Toxicity Data With Reference

1.    

orl-rat LD50:760 mg/kg

     27ZQAG    Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,429.
2.    

ipr-rat LD50:580 mg/kg

     27ZQAG    Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,429.
3.    

orl-mus LD50:999 mg/kg

     NYKZAU    Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. 62 (1966),404.
4.    

ipr-mus LD50:540 mg/kg

     27ZQAG    Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,429.

Safety Profile

Moderately toxic by ingestion and intraperitoneal routes. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx.

Specification

 2-Ethyl-3-methylpentanamide ,its cas register number is 4171-13-5. It also can be called McN-X 181 ; Pentanamide, 2-ethyl-3-methyl- ; and a-Ethyl-b-methylvaleramide .