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Cas Database |
| Name |
Bromchlorenone |
EINECS | 226-967-0 |
| CAS No. | 5579-85-1 | Density | 1.907g/cm3 |
| PSA | 46.00000 | LogP | 2.53700 |
| Solubility | N/A | Melting Point |
204.5°C |
| Formula | C7H3 Br Cl N O2 | Boiling Point | °Cat760mmHg |
| Molecular Weight | 248.463 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion and skin contact. When heated to decomposition it emits very toxic fumes of Cl−, Br−, and NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Benzoxazolinone,6-bromo-5-chloro- (6CI,7CI,8CI); 6-Bromo-5-chloro-2-benzoxazolinone;Bromchlorenone; NSC 24970; Vinyzene |
Article Data | 5 |
Bromchlorenone Chemical Properties
Product Name: Bromchlorenone (CAS NO.5579-85-1)
Molecular Formula: C7H3BrClNO2
Molecular Weight: 248.46g/mol
Mol File: 5579-85-1.mol
Einecs: 226-967-0
Density: 1.907g/cm3
Surface Tension: 54.7 dyne/cm
XLogP3-AA: 2.5
H-Bond Donor: 1
H-Bond Acceptor: 2
IUPAC Name: 6-bromo-5-chloro-3H-1,3-benzoxazol-2-one
Canonical SMILES: C1=C2C(=CC(=C1Cl)Br)OC(=O)N2
InChI: InChI=1S/C7H3BrClNO2/c8-3-1-6-5(2-4(3)9)10-7(11)12-6/h1-2H,(H,10,11)
InChIKey: KVAWWXSLBDVXHJ-UHFFFAOYSA-N
Bromchlorenone Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 222mg/kg (222mg/kg) | Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 340, 1964. | |
| mouse | LD50 | oral | 871mg/kg (871mg/kg) | Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 340, 1964. | |
| rabbit | LD50 | skin | > 3160mg/kg (3160mg/kg) | Hazelton Laboratories, Reports. Vol. -, Pg. -, 1962. | |
| rat | LD50 | oral | 500mg/kg (500mg/kg) | Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 341, 1964. |
Bromchlorenone Safety Profile
Moderately toxic by ingestion and skin contact. When heated to decomposition it emits very toxic fumes of Cl−, Br−, and NOx.
Bromchlorenone Specification
Bromchlorenone ,its CAS NO. is 5579-85-1,the synonyms is 6-Bromo-5-chloro-2-benzoxazolinone ; 6-Bromo-5-chlorobenzoxazolone ; BRN 0645274 ; Bromchlorenonum ; Vinyzene ; 2(3H)-Benzoxazolone, 6-bromo-5-chloro- ; 2-Benzoxazolinone, 6-bromo-5-chloro- .
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