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Name |
7-Chloro-2-methyl-3,3a-dihydro-2H,9H-isoxazolo(3,2-b)(1,3)benzoxazin-9-one |
EINECS | N/A |
CAS No. | 29053-27-8 | Density | 1.47g/cm3 |
PSA | 38.77000 | LogP | 2.16240 |
Solubility | N/A | Melting Point |
148°C |
Formula | C11H10 Cl N O3 | Boiling Point | 435.6°Cat760mmHg |
Molecular Weight | 239.658 | Flash Point | 217.3°C |
Transport Information | N/A | Appearance | N/A |
Safety | Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and Cl−. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
7-Chloro-3,3a-dihydro-2-methyl-2H,9H-isoxazolo-(3,2-b)(1,3)-benzoxazin-9-one;Meseclazone; NSC 297623; W 2395 |
Article Data | 2 |
The Molecular Structure of 7-Chloro-2-methyl-3,3a-dihydro-2H,9H-isoxazolo(3,2-b)(1,3)benzoxazin-9-one (CAS NO.29053-27-8):
Molecular Formula: C11H10ClNO3
Molecular Weight: 239.655000 g/mol
Index of Refraction: 1.632
Molar Refractivity: 58.07 cm3
Molar Volume: 162.7 cm3
Surface Tension: 57.6 dyne/cm
Density: 1.47 g/cm3
Flash Point: 217.3 °C
Enthalpy of Vaporization: 69.2 kJ/mol
Boiling Point: 435.6 °C at 760 mmHg
Vapour Pressure: 8.62E-08 mmHg at 25°C
InChI
InChI=1/C11H10ClNO3/c1-6-4-10-13(16-6)11(14)8-5-7(12)2-3-9(8)15-10/h2-3,5-6,10H,4H2,1H3
Smiles
N12[C@@H](Oc3ccc(cc3C1=O)Cl)C[C@@H](C)O2
The IUPAC of 7-Chloro-2-methyl-3,3a-dihydro-2H,9H-isoxazolo(3,2-b)(1,3)benzoxazin-9-one (CAS NO.29053-27-8) is 7-chloro-2-methyl-3,3a-dihydro-2H-[1,2]oxazolo[3,2-b][1,3]benzoxazin-9-one .
1. | orl-rat LD50:1160 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 33 (1975),147. | ||
2. | orl-mus LD50:2250 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 33 (1975),147. |
Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and Cl−.
7-Chloro-2-methyl-3,3a-dihydro-2H,9H-isoxazolo(3,2-b)(1,3)benzoxazin-9-one (CAS NO.29053-27-8) is also called as Meseclazone ; Meseclazone [USAN:INN] ; 2H,9H-Isoxazolo(3,2-b)(1,3)benzoxacin-9-one, 7-chloro-3,3a-dihydro-2-methyl- ; 7-Chloro-3,3a-dihydro-2-methyl-2H,9H-isoxazolo(3,2-b)(1,3)benzoxazin-9-one ; Meseclazona ; Meseclazona[INNSpanish] ; Meseclazone ; Meseclazonum ; Meseclazonum [INN-Latin] ; NSC 297623 ; UNII-51KFT71THG ; W 2395 ; 2H,9H-Isoxazolo(3,2-b)(1,3)benzoxacin-9-one, 7-chloro-3,3a-dihydro-2-methyl- ; 2H,9H-Isoxazolo(3,2-b)(1,3)benzoxazin-9-one, 3,3a-dihydro-7-chloro-2-methyl- .