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14419-59-1

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Basic Information
CAS No.: 14419-59-1
Name: P-AMINOPHENYL-2-ACETAMIDO-2-DEOXY-B-D-GL UCOPYRANOS
Article Data: 7
Molecular Structure:
Molecular Structure of 14419-59-1 (P-AMINOPHENYL-2-ACETAMIDO-2-DEOXY-B-D-GL UCOPYRANOS)
Formula: C14H20N2O6
Molecular Weight: 312.323
Synonyms: Glucopyranoside,p-aminophenyl 2-acetamido-2-deoxy-, b-D- (8CI);p-Aminophenyl-N-acetyl-b-D-glucosaminide;
Density: 1.431 g/cm3
Melting Point: 218-221 °C
Boiling Point: 670.718 °C at 760 mmHg
Flash Point: 359.437 °C
PSA: 134.27000
LogP: -0.43660
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    4-Aminophenyl 2-Acetamido-2-deoxy-b-D-glucopyranoside

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    FINETECH INDUSTRY LIMITED is a LONDON based CRO company providing drug discovery & development services to worldwide clients. FINETECH INDUSTRY LIMITED supplies the 4-Aminophenyl 2-Acetamido-2-deoxy-b-D-glucopyranoside, CAS:14419-59-1 with the most c

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Specification

The CAS registry number of b-D-Glucopyranoside, 4-aminophenyl2-(acetylamino)-2-deoxy- is 14419-59-1. The IUPAC name is N-((2S,3R,4R,5S,6R)-2-(4-aminophenoxy)-4,5-dihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-3-yl)acetamide. In addition, the molecular formula is C14H20N2O6 and the molecular weight is 312.32. What's more, it belongs to the classes of Amines; Aromatics; Carbohydrates & Derivatives. And it should be stored in a cool and dry place.

Physical properties about b-D-Glucopyranoside, 4-aminophenyl2-(acetylamino)-2-deoxy- are: (1)# of Rule of 5 Violations: 1; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 2.051; (5)ACD/KOC (pH 7.4): 2.462; (6)#H bond acceptors: 8; (7)#H bond donors: 6; (8)#Freely Rotating Bonds: 8; (9)Polar Surface Area: 134.27 Å2; (10)Index of Refraction: 1.624; (11)Molar Refractivity: 77.114 cm3; (12)Molar Volume: 218.314 cm3; (13)Polarizability: 30.57 ×10-24cm3; (14)Surface Tension: 72.749 dyne/cm; (15)Density: 1.431 g/cm3; (16)Flash Point: 359.437 °C; (17)Enthalpy of Vaporization: 103.529 kJ/mol; (18)Boiling Point: 670.718 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)N[C@H]1[C@H]([C@@H](C(O[C@H]1Oc2ccc(cc2)N)CO)O)O
(2)InChI: InChI=1/C14H20N2O6/c1-7(18)16-11-13(20)12(19)10(6-17)22-14(11)21-9-4-2-8(15)3-5-9/h2-5,10-14,17,19-20H,6,15H2,1H3,(H,16,18)/t10?,11-,12+,13+,14+/m0/s1
(3)InChIKey: RWZITXGZJXXMRL-ZPJPVDRXBA