ALLONAL: 0 Products found
Name
ALLONAL
EINECS
CAS No.
77-02-1
Density
Solubility
Melting Point
Formula
C10H14 N2 O3
Boiling Point
Molecular Weight
210.26
Flash Point
Transport Information
Appearance
Safety
Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. See also BARBITURATES and ALLYL COMPOUNDS. A sedative and hypnotic agent.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylethyl)-5-(2-propenyl)- (9CI); Barbituric acid, 5-allyl-5-isopropyl-(8CI); 5-Allyl-5-isopropylbarbituric acid; 5-Isopropyl-5-allylbarbituric acid;Allional; Allonal; Allylisopropylbarbituric acid; Allylisopropylmalonylurea;Allylpropymal; Allypropymal; Alurate; Alurate Elixir Verdum; Aprobarbital; Aprobarbitone;Aprozal; Isopropylallylbarbituric acid; NSC 120769; Numal

History

Formaldehyde was first reported by the Russian chemist Aleksandr Butlerov (1828-1886), but it was conclusively identified by August Wilhelm von Hofmann.

Chemistry

Allonal(77-02-1) is also named as aprobarbital;5-Ally-5-isopropyl barbituric acid; 5-Allyl-5-isopropylbarbituric acid; allyisopropyl-barbituric acid; allylisopropyl-malonylurea; Alurate; Numal,and so on.

CAS: 77-02-1
Molecular Formula: C10H14N2O3
Molecular Weight: 210.22976
EINECS: 200-997-4
Molecular structure:
XLogP3: 1.1
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Tautomer Count: 5
Exact Mass: 210.100442
MonoIsotopic Mass: 210.100442
Topological Polar Surface Area: 75.3
Heavy Atom Count: 15
Formal Charge: 0
Complexity: 314
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Density:1.119 g/cm3 
Index of Refraction: 1.476
Molar Refractivity: 52.98 cm3 
Molar Volume: 187.7 cm3 
Polarizability: 21 10-24cm3 
Surface Tension: 34.9 dyne/cm 

Uses

Allonal(77-02-1) is commonly used as hypnotic sedative drugs.

Toxicity

1.   

ipr-rat LDLo:100 mg/kg

   JPETAB    Journal of Pharmacology and Experimental Therapeutics. 44 (1932),325.
2.   

ipr-mus LD50:200 mg/kg

   ARZNAD    Arzneimittel-Forschung. Drug Research. 12 (1962),389.
3.   

scu-mus LD50:350 mg/kg

   ARZNAD    Arzneimittel-Forschung. Drug Research. 8 (1958),25.
4.   

orl-rbt LDLo:160 mg/kg

   JPETAB    Journal of Pharmacology and Experimental Therapeutics. 44 (1932),325.
5.   

ipr-rbt LDLo:90 mg/kg

   JPETAB    Journal of Pharmacology and Experimental Therapeutics. 44 (1932),325.

RTECS:  CP8925000

Safety

Allonal(77-02-1) is poisonous by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. A sedative and hypnotic agent.