4'-Nitrophenyl-2-acetamido-2-deoxy-alpha-D-glucopyranoside

Base Information

• Chemical Name: 4'-Nitrophenyl-2-acetamido-2-deoxy-alpha-D-glucopyranoside
• CAS No.: 10139-02-3
• Molecular Formula: C14H18 N2 O8
• Molecular Weight: 342.3
• Hs Code.: 29329990
• European Community (EC) Number: 233-392-9
• DSSTox Substance ID: DTXSID80906117
• Nikkaji Number: J227.068D
• Wikidata: Q27162475
• Mol file: 10139-02-3.mol

Synonyms:10139-02-3;N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]acetamide;4-Nitrophenyl N-acetyl-|A-D-glucosaminide;p-Nitrophenyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside;4'-Nitrophenyl-2-acetamido-2-deoxy-alpha-D-glucopyranoside;N-((2R,3R,4R,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydro-2H-pyran-3-yl)acetamide;4-Nitrophenyl N-acetyl-alpha-D-glucosaminide;EINECS 233-392-9;4-Nitrophenyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside;p-nitrophenyl N-acetyl-alpha-D-glucosaminide;a-D-Glucopyranoside, 4-nitrophenyl2-(acetylamino)-2-deoxy-;alpha-D-Glucopyranoside, 4-nitrophenyl 2-(acetylamino)-2-deoxy-;4-nitrophenyl-n-acetyl-alpha-d-glucosaminide;SCHEMBL419721;CHEBI:90341;DTXSID80906117;AMY41700;MFCD00006592;AKOS015919381;HY-137421;CS-0138587;4-Nitrophenyl N-acetyl-I+/--D-glucosaminide;4-Nitrophenyl N-acetyl- alpha -D-glucosaminide;C13989;A800383;p-NITROPHENYL-N-ACETYL-alpha-D-GLUCOSAMINIDE;4-nitrophenyl 2-acetamido-2-deoxy-alpha-D-glucoside;p-nitrophenyl 2-acetamido-2-deoxy-alpha-D-glucoside;4-Nitrophenyl N-acetyl-alpha-D-glucosaminide, >=98%;Q27162475;p-Nitrophenyl 2-acetamido-2-deoxy-alpha-Dglucopyranoside;P-NITROPHENYL 2-ACETAMIDO-2-DEOXY-a-D-GLUCOPYRANOSIDE;4-Nitrophenyl 2-deoxy-2-[(1-hydroxyethylidene)amino]hexopyranoside;4-Nitrophenyl-N-acetyl-alpha-D-glucosaminide, 4-Nitrophenyl-N-acetyl-alpha-D-glucosamine;N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydropyran-3-yl]acetamide;6ZC;N-[(2r,3r,4r,5s,6r)-6-(Hydroxymethyl)-2-(4-Nitrophenoxy)-4,5-Bis(Oxidanyl)oxan-3-Yl]ethanamide

Chemical Property of 4'-Nitrophenyl-2-acetamido-2-deoxy-alpha-D-glucopyranoside

Chemical Property:

• Melting Point: 264 °C
• Refractive Index: 1.5110 (estimate)
• Boiling Point: 694.7°Cat760mmHg
• PKA: 12.76±0.70(Predicted)
• Flash Point: 374°C
• PSA: 154.07000
• Density: 1.51g/cm³
• LogP: -0.16860
• Storage Temp.: −20°C
• Solubility.: DMSO (Slightly), Methanol (Slightly), Water (Slightly, heated)
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 342.10631554
• Heavy Atom Count: 24
• Complexity: 449

Purity/Quality:

98%, ^*data from raw suppliers

p-Nitrophenyl 2-Acetamido-2-deoxy-a-D-glucopyranoside ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)O
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)O
• Uses: P-NITROPHENYL 2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSIDE is a useful substrate for assays of N-acetyl-alpha-galactosaminidase used in detection of Sanfilippo syndrome B substrate for b-L-fucosidases A useful substrate for assays of N-acetyl-alpha-galactosaminidase used in detection of Sanfilippo syndrome B.