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Name |
7-Methyl-2H-1,3-benzoxazine-2,4(3H)-dione |
EINECS | N/A |
CAS No. | 24088-77-5 | Density | 1.336 g/cm3 |
PSA | 63.07000 | LogP | 0.78970 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H7NO3 | Boiling Point | 357-358℃ at 100.9kPa |
Molecular Weight | 177.159 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
7-Methyl-2H-1,3-benzoxazine-2,4(3H)-dione;7-Methyl-2H-benzo[e][1,3]oxazine-2,4(3H)-dione |
The 7-Methyl-1,3-Benzoxazine-2,4-dione is an organic compound with the formula C9H7NO3. The systematic name of this chemical is 7-methyl-2H-1,3-benzoxazine-2,4(3H)-dione. With the CAS registry number 24088-77-5, it is also named as 2H-1,3-benzoxazine-2,4(3H)-dione, 7-methyl-.
Physical properties about 7-Methyl-1,3-Benzoxazine-2,4-dione are: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 6; (5)ACD/BCF (pH 7.4): 6; (6)ACD/KOC (pH 5.5): 132; (7)ACD/KOC (pH 7.4): 131; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)Polar Surface Area: 55.4 Å2; (11)Index of Refraction: 1.576; (12)Molar Refractivity: 43.855 cm3; (13)Molar Volume: 132.609 cm3; (14)Polarizability: 17.385×10-24cm3; (15)Surface Tension: 48.338 dyne/cm; (16)Density: 1.336 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1c2c(OC(=O)N1)cc(cc2)C
(2)InChI: InChI=1/C9H7NO3/c1-5-2-3-6-7(4-5)13-9(12)10-8(6)11/h2-4H,1H3,(H,10,11,12)
(3)InChIKey: HQUVXRFXGBZDNB-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C9H7NO3/c1-5-2-3-6-7(4-5)13-9(12)10-8(6)11/h2-4H,1H3,(H,10,11,12)
(5)Std. InChIKey: HQUVXRFXGBZDNB-UHFFFAOYSA-N