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| Name |
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime |
EINECS | N/A |
| CAS No. | 6813-92-9 | Density | 1.14g/cm3 |
| PSA | 41.82000 | LogP | 2.09960 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H17NO2 | Boiling Point | 354.7°Cat760mmHg |
| Molecular Weight | 219.283 | Flash Point | 168.3°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime Chemical Properties
Empirical Formula of O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime (CAS NO.6813-92-9): C13H17NO2
Molecular Weight: 219.2796
Index of Refraction: 1.564
Density: 1.144 g/cm3
Flash Point: 168.295 °C
Enthalpy of Vaporization: 63.284 kJ/mol
Boiling Point: 354.663 °C at 760 mmHg
Structure of O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime (CAS NO.6813-92-9):
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IUPAC Name: 1-[(E)-1-(8-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino]oxypropan-2-ol
Canonical SMILES: CC(CON=C(C)C1CC2=CC=CC=C12)O
Isomeric SMILES: CC(CO/N=C(\C)/C1CC2=CC=CC=C12)O
InChI: InChI=1S/C13H17NO2/c1-9(15)8-16-14-10(2)13-7-11-5-3-4-6-12(11)13/h3-6,9,13,15H,7-8H2,1-2H3/b14-10+
InChIKey: VKFNGVQUSMHREJ-GXDHUFHOSA-N
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime Toxicity Data With Reference
| 1. | ipr-mus LD50:550 mg/kg | JMCMAR Journal of Medicinal Chemistry. 9 (1966),656. |
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime Safety Profile
Moderately toxic by intraperitoneal route. A flammable liquid. When heated to decomposition O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime (CAS NO.6813-92-9) emits toxic vapors of NOx.
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime Specification
O-(2-Hydroxypropyl)-1-acetylbenzocyclobutene oxime , its cas register number is 6813-92-9. It also can be called BRN 2457552 ; Ketone, bicyclo(4.2.0)octa-1,3,5-trien-7-yl methyl, O-(2-hydroxypropyl)oxime ; and Bicyclo(4.2.0)octa-1,3,5-trien-7-yl methyl ketone O-(2-hydroxypropyl)oxime .
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