4-Aminophenyl 6-O-phosphono-α-D-mannopyranoside supplier

Name
4-aminophenyl 6-phospho-alpha-mannopyranoside
EINECS
CAS No. 74160-60-4
Density 1.698g/cm³
Solubility
Melting Point
Formula C12H18 N O9 P
Boiling Point 680.7°C at 760 mmHg
Molecular Weight 351.25
Flash Point 365.5°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms p-Aminophenyl6-phospho-a-D-mannopyranoside;
PSA
LogP

4-Aminophenyl 6-O-phosphono-α-D-mannopyranoside Specification

The 4-Aminophenyl 6-O-phosphono-α-D-mannopyranoside, with the CAS registry number 74160-60-4. It belongs to the product categories of manna sugars.. This chemical's molecular formula is C₁₂H₁₈NO₉P and molecular weight is 351.24. Its systematic name is alpha-D-Mannopyranoside, 4-aminophenyl, 6-(dihydrogenphosphate).

Physical properties about 4-Aminophenyl 6-O-phosphono-α-D-mannopyranoside are: (1)ACD/LogP: -4.067; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): -7.14; (4)ACD/LogD (pH 7.4): -8.33; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 10; (10)#H bond donors: 7; (11)#Freely Rotating Bonds: 9; (12)Index of Refraction: 1.66; (13)Molar Refractivity: 76.35 cm₃; (14)Molar Volume: 206.81 cm₃; (15)Surface Tension: 86.9540023803711 dyne/cm; (16)Density: 1.698 g/cm₃; (17)Flash Point: 365.461 °C; (18)Enthalpy of Vaporization: 104.91 kJ/mol; (19)Boiling Point: 680.677 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C;

You can still convert the following datas into molecular structure:
(1)SMILES:O=P(O)(O)OC[C@H]2O[C@H](Oc1ccc(N)cc1)[C@@H](O)[C@@H](O)[C@@H]2O;
(2)Std. InChI:InChI=1S/C12H18NO9P/c13-6-1-3-7(4-2-6)21-12-11(16)10(15)9(14)8(22-12)5-20-23(17,18)19/h1-4,8-12,14-16H,5,13H2,(H2,17,18,19)/t8-,9-,10+,11+,12+/m1/s1;
(3)Std. InChIKey:CJTXANSQOPINCC-GCHJQGSQSA-N;

Product Name

4-aminophenyl 6-phospho-alpha-mannopyranoside

4-Aminophenyl 6-O-phosphono-α-D-mannopyranoside Specification

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