CAS No.575-64-4,mannurono-gamma-lactone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	575-64-4
Name:	mannurono-gamma-lactone
Article Data:	2

Formula:	C₆H₈O₆
Molecular Weight:	176.126
Synonyms:	Mannofuranuronicacid, g-lactone, D- (8CI);Furo[3,2-b]furan, D-mannofuranuronic acid deriv.;NSC 25287;
Density:	1.904 g/cm³
Boiling Point:	488.9 °C at 760 mmHg
Flash Point:	214.2 °C
PSA:	96.22000
LogP:	-2.64920

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Specification

The D-Mannofuranuronicacid, g-lactone, with the CAS registry number 575-64-4, is also known as 3,5,6-Trihydroxytetrahydrofuro[3,2-b]furan-2(3H)-one. This chemical's molecular formula is C₆H₈O₆ and molecular weight is 176.1241. What's more, its IUPAC name is called 2,3,6-Trihydroxy-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one.

Physical properties about D-Mannofuranuronicacid, g-lactone are: (1)ACD/LogP: -1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.56; (4)ACD/LogD (pH 7.4): -1.56; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.4; (8)ACD/KOC (pH 7.4): 3.4; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 63.22 Å²; (13)Index of Refraction: 1.652; (14)Molar Refractivity: 33.83 cm³; (15)Molar Volume: 92.4 cm³; (16)Surface Tension: 107.5 dyne/cm; (17)Density: 1.904 g/cm³; (18)Flash Point: 214.2 °C; (19)Enthalpy of Vaporization: 87 kJ/mol; (20)Boiling Point: 488.9 °C at 760 mmHg; (21)Vapour Pressure: 1.31E-11 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2OC1C(OC(O)C1O)C2O
(2) InChI: InChI=1/C6H8O6/c7-1-3-4(12-5(1)9)2(8)6(10)11-3/h1-5,7-9H
(3) InChIKey: OGLCQHRZUSEXNB-UHFFFAOYAO