CAS No.72363-26-9,C.I. 60752 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	72363-26-9
Name:	C.I. 60752
Article Data:	1

Formula:	C₂₅H₂₄N₂O₇S
Molecular Weight:	496.541
Synonyms:	C.I. 60752;C.I. Disperse Red 92;Disperse Red 92;Kiwalon Polyester Red BFL;NavileneBrilliant Red BEL;Navilene Red BEL;Palanil Brilliant Red BEL;SumikaronBrilliant Red S-BLF;Sumikaron Brilliant Red S-BLF liquid;
EINECS:	276-602-4
Density:	1.405 g/cm³
Boiling Point:	713.7 °C at 760 mmHg
Flash Point:	385.5 °C
Solubility:	8.1mg/L at 20℃
PSA:	153.40000
LogP:	5.29990

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Specification

The cas register number of Disperse Red 92 is 72363-26-9. It also can be called as Benzenesulfonamide, 4-((1-amino-9,10-dihydro-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy)-N-(3-ethoxypropyl)- and the IUPAC Name about this chemical is 4-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxy-N-(3-ethoxypropyl)benzenesulfonamide.

Physical properties about Disperse Red 92 are: (1)ACD/LogP: 5.27; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.24; (4)ACD/LogD (pH 7.4): 4.45; (5)ACD/BCF (pH 5.5): 5585.47; (6)ACD/BCF (pH 7.4): 905.4; (7)ACD/KOC (pH 5.5): 16416.77; (8)ACD/KOC (pH 7.4): 2661.14; (9)#H bond acceptors: 9; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 110.83Å²; (13)Index of Refraction: 1.643; (14)Molar Refractivity: 127.85 cm³; (15)Molar Volume: 353.3 cm³; (16)Polarizability: 50.68x10^-24cm³; (17)Surface Tension: 63.4 dyne/cm; (18)Enthalpy of Vaporization: 108.05 kJ/mol; (19)Boiling Point: 713.7 °C at 760 mmHg; (20)Vapour Pressure: 4.77E-21 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(NCCCOCC)c4ccc(Oc3c(c2C(=O)c1ccccc1C(=O)c2c(O)c3)N)cc4
(2)InChI: InChI=1/C25H24N2O7S/c1-2-33-13-5-12-27-35(31,32)16-10-8-15(9-11-16)34-20-14-19(28)21-22(23(20)26)25(30)18-7-4-3-6-17(18)24(21)29/h3-4,6-11,14,27-28H,2,5,12-13,26H2,1H3
(3)InChIKey: ALXCWDABTQQKAH-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C25H24N2O7S/c1-2-33-13-5-12-27-35(31,32)16-10-8-15(9-11-16)34-20-14-19(28)21-22(23(20)26)25(30)18-7-4-3-6-17(18)24(21)29/h3-4,6-11,14,27-28H,2,5,12-13,26H2,1H3
(5)Std. InChIKey: ALXCWDABTQQKAH-UHFFFAOYSA-N