CAS No.32860-62-1,MALTOTRIITOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	32860-62-1
Name:	MALTOTRIITOL
Article Data:	4

Formula:	C₁₈H₃₄O₁₆
Molecular Weight:	506.458
Synonyms:	Maltotriitol;α-d-glc-(1→4)-α-d-glc-(1→4)-d-glucitol;
EINECS:	251-265-6
Density:	1.75 g/cm³
Melting Point:	184°C
Boiling Point:	970.5 °C at 760 mmHg
Flash Point:	540.7 °C
Solubility:	SOLUBILITY, CLEAR COLORLESS SOLUTION AT 50MG/ML IN WATER
Appearance:	WHITE POWDER
Safety:	24/25
PSA:	279.68000
LogP:	-7.93700

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Specification

The Maltotriitol with the cas number 32860-62-1 is also called α-d-glc-(1→4)-α-d-glc-(1→4)-d-glucitol. The IUPAC name is (2S,3R,5R)-4-[(2R,3R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol. Its EINECS registry number is 251-265-6. The molecular formula is C₁₈H₃₄O₁₆. This chemical should be stored at −20°C.

The properties of the chemical are: (1)ACD/LogP: -5.20; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): -5.2; (4)ACD/LogD (pH 7.4): -5.2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 16; (10)#H bond donors: 12; (11)#Freely Rotating Bonds: 23; (12)Polar Surface Area: 147.68 Å²; (13)Index of Refraction: 1.66; (14)Molar Refractivity: 106.38 cm³; (15)Molar Volume: 288.1 cm³; (16)Polarizability: 42.17×10^-24cm³; (17)Surface Tension: 117.6 dyne/cm; (18)Enthalpy of Vaporization: 160.29 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O([C@H]1C(O)[C@@H](O)[C@@H](OC([C@H](O)[C@@H](O)CO)[C@H](O)CO)O[C@@H]1CO)[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO
(2)InChI: InChI=1/C18H34O16/c19-1-5(23)9(25)15(6(24)2-20)33-18-14(30)12(28)16(8(4-22)32-18)34-17-13(29)11(27)10(26)7(3-21)31-17/h5-30H,1-4H2/t5-,6+,7+,8+,9+,10+,11-,12?,13+,14+,15?,16+,17+,18+/m0/s1
(3)InChIKey: XJCCHWKNFMUJFE-CLYXNOERBH