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108342-87-6

Basic Information
CAS No.: 108342-87-6
Name: 2,3,4,6-Tetra-O-pivaloyl-D-galactopyranosylamine
Article Data: 6
Molecular Structure:
Molecular Structure of 108342-87-6 (2,3,4,6-Tetra-O-pivaloyl-D-galactopyranosylamine)
Formula: C26H45NO9
Molecular Weight: 515.645
Synonyms: 2,3,4,6-Tetra-O-pivaloyl-b-D-galactopyranosylamine;
Density: 1.117 g/cm3
Melting Point: 92-95 °C(lit.)
Boiling Point: 528.692 °C at 760 mmHg
Flash Point: 75.917 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 140.45000
LogP: 3.83330
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Specification

The 2,3,4,6-Tetra-O-pivaloyl-D-galactopyranosylamine is an organic compound with the formula C26H45NO9. The systematic name of this chemical is 2,3,4,6-tetrakis-O-(2,2-dimethylpropanoyl)-β-D-galactopyranosylamine. With the CAS registry number 108342-87-6, it is also named as β-D-galactopyranosylamine, 2,3,4,6-tetrakis(2,2-dimethylpropanoate). The product's categories are Carbohydrate Synthesis; Monosaccharides; Specialty Synthesis. Besides, it should be stored in a closed cool and dry place.

Physical properties about 2,3,4,6-Tetra-O-pivaloyl-D-galactopyranosylamine are: (1)ACD/LogP: 5.75; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 4.29; (4)ACD/LogD (pH 7.4): 5.62; (5)ACD/BCF (pH 5.5): 476.67; (6)ACD/BCF (pH 7.4): 10179.77; (7)ACD/KOC (pH 5.5): 1103.38; (8)ACD/KOC (pH 7.4): 23563.96; (9)#H bond acceptors: 10; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 117.67 Å2; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 133.1 cm3; (15)Molar Volume: 461.4 cm3; (16)Polarizability: 52.76×10-24cm3; (17)Surface Tension: 41.1 dyne/cm; (18)Density: 1.11 g/cm3; (19)Flash Point: 75.9 °C; (20)Enthalpy of Vaporization: 80.36 kJ/mol; (21)Boiling Point: 528.7 °C at 760 mmHg; (22)Vapour Pressure: 2.9E-11 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC[C@H]1O[C@@H](N)[C@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@H]1OC(=O)C(C)(C)C)C(C)(C)C
(2)InChI: InChI=1/C26H45NO9/c1-23(2,3)19(28)32-13-14-15(34-20(29)24(4,5)6)16(35-21(30)25(7,8)9)17(18(27)33-14)36-22(31)26(10,11)12/h14-18H,13,27H2,1-12H3/t14-,15+,16+,17-,18-/m1/s1
(3)InChIKey: IPRZVEFFDTWBGV-DISONHOPBM
(4)Std. InChI: InChI=1S/C26H45NO9/c1-23(2,3)19(28)32-13-14-15(34-20(29)24(4,5)6)16(35-21(30)25(7,8)9)17(18(27)33-14)36-22(31)26(10,11)12/h14-18H,13,27H2,1-12H3/t14-,15+,16+,17-,18-/m1/s1
(5)Std. InChIKey: IPRZVEFFDTWBGV-DISONHOPSA-N