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| CAS No.: | 26301-79-1 |
|---|---|
| Name: | D-Mannono-1,4-lactone |
| Article Data: | 26 |
| Molecular Structure: | |
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| Formula: | C6H10O6 |
| Molecular Weight: | 178.142 |
| Synonyms: | Mannonicacid, g-lactone, D- (8CI);D-Mannonic acid, g-lactone;D-Mannono-g-lactone;Mannonic acid 1,4-lactone;NSC 1971;5-(1,2-Dihydroxyethyl)-3,4-dihydroxytetrahydrofuran-2-one; |
| EINECS: | 247-596-0 |
| Density: | 1.766 g/cm3 |
| Melting Point: | 153 °C |
| Boiling Point: | 467.9 °C at 760 mmHg |
| Flash Point: | 201.5 °C |
| Solubility: | within almost transparency |
| PSA: | 107.22000 |
| LogP: | -3.01320 |
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Specification
The D-Mannono-1,4-lactone, with the CAS registry number 10578-34-4, is also known as Mannonic acid 1,4-lactone. It belongs to the product categories of Biochemistry; Sugar Acids; Sugars. Its EINECS number is 247-596-0. This chemical's molecular formula is C6H10O6 and molecular weight is 178.14. What's more, its IUPAC name is 5-(1,2-dihydroxyethyl)-3,4-dihydroxyoxolan-2-one.
Physical properties of D-Mannono-1,4-lactone are: (1)ACD/LogP: -3.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.15; (4)ACD/BCF (pH 5.5): 1; (5)ACD/KOC (pH 5.5): 1; (6)#H bond acceptors: 6; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 63.22 Å2; (10)Index of Refraction: 1.625; (11)Molar Refractivity: 35.66 cm3; (12)Molar Volume: 100.8 cm3; (13)Polarizability: 14.13×10-24cm3; (14)Surface Tension: 109.3 dyne/cm; (15)Density: 1.766 g/cm3; (16)Flash Point: 201.5 °C; (17)Enthalpy of Vaporization: 84.17 kJ/mol; (18)Boiling Point: 467.9 °C at 760 mmHg; (19)Vapour Pressure: 1.01E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(C(C1C(C(C(=O)O1)O)O)O)O
(2)InChI: InChI=1S/C6H10O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-5,7-10H,1H2
(3)InChIKey: SXZYCXMUPBBULW-UHFFFAOYSA-N