CAS No.31077-88-0,2-DEOXY-2-FLUORO-D-MANNOSE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	31077-88-0
Name:	2-DEOXY-2-FLUORO-D-MANNOSE
Article Data:	22

Formula:	C₆H₁₁FO₅
Molecular Weight:	182.149
Synonyms:	Mannopyranose,2-deoxy-2-fluoro-, D- (8CI);
Density:	1.494 g/cm³
Melting Point:	123-128 ºC
Boiling Point:	478.4 ºC at 760 mmHg
Flash Point:	243.1 ºC
Solubility:	at 25 deg C (mg/L): 1e+006
Appearance:	Colourless semisolid
Hazard Symbols:	Xi
PSA:	90.15000
LogP:	-2.24420

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Specification

The D-Mannopyranose,2-deoxy-2-fluoro-, with the CAS registry number 31077-88-0, is also known as 2-Deoxy-2-fluoromannose. It belongs to the product categories of 13C & 2H Sugars; Carbohydrates & Derivatives. This chemical's molecular formula is C₆H₁₁FO₅ and molecular weight is 182.15. What's more, its systematic name is called 2-Deoxy-2-fluoro-D-mannopyranose. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about D-Mannopyranose,2-deoxy-2-fluoro- are: (1)ACD/LogP: -1.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.34; (4)ACD/LogD (pH 7.4): -1.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.46; (8)ACD/KOC (pH 7.4): 4.46; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 46.15 Å²; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 35.66 cm³; (15)Molar Volume: 114.4 cm³; (16)Surface Tension: 67.5 dyne/cm; (17)Density: 1.59 g/cm³; (18)Flash Point: 186.3 °C; (19)Enthalpy of Vaporization: 76.99 kJ/mol; (20)Boiling Point: 413.6 °C at 760 mmHg; (21)Vapour Pressure: 1.44E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: F[C@H]1[C@@H](O)[C@H](O)[C@H](OC1O)CO
(2) InChI: InChI=1/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3+,4-,5-,6?/m1/s1
(3) InChIKey: ZCXUVYAZINUVJD-CBPJZXOFBM