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Cas Database |
| Name |
Isocil |
EINECS | N/A |
| CAS No. | 314-42-1 | Density | 1.522g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H11 Br N2 O2 | Boiling Point | N/A |
| Molecular Weight | 247.092 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. See also BROMIDES. When heated to decomposition it emits very toxic fumes of Br− and NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | Toxic by ingestion. |
| Synonyms |
Uracil,5-bromo-3-isopropyl-6-methyl- (8CI); 3-Isopropyl-5-bromo-6-methyluracil;5-Bromo-3-isopropyl-6-methyluracil;5-Bromo-6-methyl-3-(1-methylethyl)-2,4(1H,3H)-pyrimidinedione; H 82; Hyvar;Isocil; Isocil (herbicide); NSC 75241 |
Article Data | 3 |
Isocil Chemical Properties
Product Name: Isocil (CAS NO.314-42-1)
Molecular Formula: C8H11BrN2O2
Molecular Weight: 247.12g/mol
Mol File: 314-42-1.mol
Density: 1.522 g/cm3
Surface Tension: 43.4 dyne/cm
XLogP3-AA: 1.6
H-Bond Donor: 1
H-Bond Acceptor: 2
IUPAC Name: 5-bromo-6-methyl-3-propan-2-yl-1H-pyrimidine-2,4-dione
Canonical SMILES: CC1=C(C(=O)N(C(=O)N1)C(C)C)Br
InChI: InChI=1S/C8H11BrN2O2/c1-4(2)11-7(12)6(9)5(3)10-8(11)13/h4H,1-3H3,(H,10,13)
InChIKey: PSYBGEADHLUXCS-UHFFFAOYSA-N
Isocil Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LDLo | oral | 3750mg/kg (3750mg/kg) | Toxicology and Applied Pharmacology. Vol. 23, Pg. 288, 1972. | |
| rat | LD50 | oral | 3400mg/kg (3400mg/kg) | Residue Reviews. Vol. 10, Pg. 97, 1965. |
Isocil Safety Profile
Moderately toxic by ingestion. See also BROMIDES. When heated to decomposition it emits very toxic fumes of Br− and NOx.
Isocil Specification
Isocil ,its CAS NO. is 314-42-1,the synonyms is 2,4(1H,3H)-pyrimidinedione, 5-bromo-6-methyl-3-(1-methylethyl)- (9CI) ; 3-Isopropyl-5-bromo-6-methyluracil ; 5-24-07-00039 (Beilstein Handbook Reference) ; 5-Brom-3-isopropyl-6-methyl-uracil ; 5-Bromo-3-isopropyl-6-methyl, 2,4-pyrimidinedione ; 5-Bromo-6-methyl-3-(1-methylethyl)-2,4-(1H,3H)-pyrimidinedione ; Caswell No. 504 ; Du Pont herbicide 82 ; EINECS 206-247-2 ; EPA Pesticide Chemical Code 011801 ; Uracil, 5-bromo-3-isopropyl-6-methyl- (8CI) .
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