CAS No.4292-12-0,1,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranose Suppliers

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Basic Information

Molecular Structure:
CAS No.:	4292-12-0
Name:	1,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranose

Formula:	C₁₄H₂₀O₁₀
Molecular Weight:	348.30
Synonyms:	1,3,4,6-Tetra-O-acetyl-α-D-glucopyranose;α-D-glucopyranose, 1,3,4,6-tetraacetate;
EINECS:	209-339-0
Density:	1.49g/cm³
Boiling Point:	425.537 °C at 760 mmHg
Flash Point:	148.725 °C
PSA:	134.66000
LogP:	-0.93820

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Specification

The 1,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranose, with cas registry number 4292-12-0, has the systematic name of 1,3,4,6-tetra-O-acetyl-α-D-glucopyranose. Besides this, it is also called α-D-glucopyranose, 1,3,4,6-tetraacetate.

Physical properties about this chemical are: (1)ACD/LogP: 0.24; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 25; (8)ACD/KOC (pH 7.4): 25; (9)#H bond acceptors: 10; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 134.66 Å²; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 75.418 cm³; (15)Molar Volume: 260.069 cm³; (16)Polarizability: 29.898×10^-24cm³; (17)Surface Tension: 49.682 dyne/cm; (18)Enthalpy of Vaporization: 78.551 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)O[C@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1O
(2)InChI: InChI=1/C14H20O10/c1-6(15)20-5-10-12(21-7(2)16)13(22-8(3)17)11(19)14(24-10)23-9(4)18/h10-14,19H,5H2,1-4H3/t10-,11-,12-,13-,14+/m1/s1
(3)InChIKey: SHBHJRVMGYVXKK-KSTCHIGDBN
(4)Std. InChI: InChI=1S/C14H20O10/c1-6(15)20-5-10-12(21-7(2)16)13(22-8(3)17)11(19)14(24-10)23-9(4)18/h10-14,19H,5H2,1-4H3/t10-,11-,12-,13-,14+/m1/s1
(5)Std. InChIKey: SHBHJRVMGYVXKK-KSTCHIGDSA-N