4-NITROPHENYL-ALPHA-D-MANNOPYRANOSIDE

The a-D-Mannopyranoside, 4-nitrophenyl, with the CAS registry number 10357-27-4, is also known as 4-nitrophenyl α-D-mannopyranoside. It belongs to the product categories of Substrates; 13C & 2H Sugars; Biochemistry; Glycosides; Sugars; Carbohydrates & Derivatives; ChromogenicEnzyme Substrates; Mannosidase, alpha-; Mannoside; Substrates by Enzyme. Its EINECS registry number is 233-776-6. This chemical's molecular formula is C₁₂H₁₅NO₈ and molecular weight is 301.2494. What's more, its IUPAC name is (2R,3S,4S,5S,6R)-2-(Hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol. Besides, it is crystalline.

Physical properties about a-D-Mannopyranoside, 4-nitrophenyl are: (1)ACD/LogP: -0.55; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 9; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 8; (6)Polar Surface Area: 101.2 Å²; (7)Index of Refraction: 1.647; (8)Molar Refractivity: 68.5 cm³; (9)Molar Volume: 188.3 cm³; (10)Polarizability: 27.15×10^-24cm³; (11)Surface Tension: 74.1 dyne/cm; (12)Density: 1.599 g/cm³; (13)Flash Point: 305.9 °C; (14)Enthalpy of Vaporization: 91.56 kJ/mol; (15)Boiling Point: 582.2 °C at 760 mmHg; (16)Vapour Pressure: 2.14E-14 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: As a chemical, it is irritating to eyes, respiratory system. Besides, this chemical causes inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing, gloves and eye/face protection and avoid contact with skin and eyes. In case of contact with eyes or skin, rinse immediately with plenty of water and seek medical advice. In addition, it should place in a cool and dry place.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c2ccc(O[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)CO)cc2
(2) InChI: InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11+,12+/m1/s1
(3) InChIKey: IFBHRQDFSNCLOZ-GCHJQGSQBP