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Home > Nitro Compounds > 6819-07-4
6819-07-4 | 4-Nitrophenyl b-D-xylobioside
CAS No: 6819-07-4 Catalog No: AG01E9XP MDL No:
Product Description
Catalog Number:
AG01E9XP
Chemical Name:
4-Nitrophenyl b-D-xylobioside
CAS Number:
6819-07-4
IUPAC Name:
(2S,3R,4S,5R)-2-[(3R,4R,5R,6S)-4,5-dihydroxy-6-(4-nitrophenoxy)oxan-3-yl]oxyoxane-3,4,5-triol
InChI:
InChI=1S/C16H21NO11/c18-9-5-25-16(13(21)11(9)19)28-10-6-26-15(14(22)12(10)20)27-8-3-1-7(2-4-8)17(23)24/h1-4,9-16,18-22H,5-6H2/t9-,10-,11+,12+,13-,14-,15+,16+/m1/s1
InChI Key:
LPCFVCUKBNKNBF-DDJMUGOQSA-N
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
8
Defined Bond Stereocenter Count:
0
Exact Mass:
403.111g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
403.34g/mol
Monoisotopic Mass:
403.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
184A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9
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