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CAS No.: | 6359-29-1 |
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Name: | Mordant Red 15 |
Molecular Structure: | |
Formula: | C25H21 N O6 |
Molecular Weight: | 431.44 |
Synonyms: | 3H-Xanthene-2-carboxylicacid, 9-(o-carboxyphenyl)-6-(diethylamino)-3-oxo- (7CI,8CI);Basolan ChromeBrilliant Red 3BB;C.I. 45305;C.I. Mordant Red 15;Sunchromine Brilliant Red B;6'-(diethylamino)-3'-hydroxy-3-oxospiro(isobenzofuran-1;(3h),9'-(9h)xanthene)-2'-carboxylic acid;mordant red 15;Acid mordant Red 15;Acid mordant pink 3BM;ACID CHROME PINK 3BM;Pink 2BM;9-(2-Carboxyphenyl)-6-(diethylamino)-3-oxo-3H-xanthene-2-carboxylic acid;Sunchromine Brilliant Red B; |
EINECS: | 228-797-2 |
Density: | 1.48 g/cm3 |
Boiling Point: | 683.7 °C at 760 mmHg |
Flash Point: | 367.3 °C |
Solubility: | Soluble in water with yellow fluorescence fide |
Appearance: | Dark red power |
PSA: | 96.30000 |
LogP: | 4.50460 |
The Mordant Red 15 with cas registry number of 6359-29-1, is also named Basolan ChromeBrilliant Red 3BB ;Sunchromine Brilliant Red B .
Physical properties of Mordant Red 15 :(1)ACD/LogP: 4.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.97; (4)ACD/LogD (pH 7.4): 1.63; (5)ACD/BCF (pH 5.5): 3.98; (6)ACD/BCF (pH 7.4): 1.79; (7)ACD/KOC (pH 5.5): 15; (8)ACD/KOC (pH 7.4): 6.77; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 74.3 Å2; (13)Index of Refraction: 1.722; (14)Molar Refractivity: 115.13 cm3; (15)Molar Volume: 290.8 cm3; (16)Polarizability: 45.64×10-24cm3; (17)Surface Tension: 79.9 dyne/cm; (18)Enthalpy of Vaporization: 105.33 kJ/mol; (19)Vapour Pressure: 1.25E-19 mmHg at 25°C.
The mainly usage of Mordant Red 15 : coloring the carpet, wool and the other wool fabric.
You can still convert the following datas into molecular structure: (1)SMILES:O=C(O)c5cc4c(Oc1cc(N(CC)CC)ccc1C34OC(=O)c2c3cccc2)cc5O; (2)InChI:InChI=1/C25H21NO6/c1-3-26(4-2)14-9-10-18-21(11-14)31-22-13-20(27)16(23(28)29)12-19(22)25(18)17-8-6-5-7-15(17)24(30)32-25/h5-13,27H,3-4H2,1-2H3,(H,28,29)InChIKey:; (3)LJYFQGHCZXNILU-UHFFFAOYAF; (4)Std. InChI:InChI=1S/C25H21NO6/c1-3-26(4-2)14-9-10-18-21(11-14)31-22-13-20(27)16(23(28)29)12-19(22)25(18)17-8-6-5-7-15(17)24(30)32-25/h5-13,27H,3-4H2,1-2H3,(H,28,29); (5)Std. InChIKey:LJYFQGHCZXNILU-UHFFFAOYSA-N .