4-Nitrophenyl-n-acetyl-beta-D-galactosaminide

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Catalog Number
ACM14948960
Product Name
4-Nitrophenyl-n-acetyl-beta-D-galactosaminide
Structure
Structure
CAS
14948-96-0
Category
Heterocyclic Organic Compound
Synonyms
GalNAc-beta-PNP
IUPAC Name
N-[(2S,3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]acetamide
Molecular Weight
342.3
Molecular Formula
C14H18N2O8
Canonical 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
InChI
InChI=1S/C14H18N2O8/c1-7(18)15-11-13(20)12(19)10(6-17)24-14(11)23-9-4-2-8(3-5-9)16(21)22/h2-5,10-14,17,19-20H,6H2,1H3,(H,15,18)/t10-,11-,12+,13-,14-/m1/s1
InChI Key
OMRLTNCLYHKQCK-RKQHYHRCSA-N
Boiling Point
694.7±55.0 °C
Melting Point
181 °C
Density
1.51±0.1 g/ml
Appearance
White to off-white solid
pKa
12.76±0.70
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