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10256-24-3,MFCD07369611
Catalog No.:AA0007MZ
10256-24-3 | β-D-Xylopyranoside, 2-nitrophenyl, 2,3,4-triacetate
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  • Technical Information
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Technical Information
Catalog Number:
AA0007MZ
Chemical Name:
β-D-Xylopyranoside, 2-nitrophenyl, 2,3,4-triacetate
CAS Number:
10256-24-3
Molecular Formula:
C17H19NO10
Molecular Weight:
397.3335
MDL Number:
MFCD07369611
IUPAC Name:
[(3R,4S,5R,6S)-4,5-diacetyloxy-6-(2-nitrophenoxy)oxan-3-yl] acetate
InChI:
InChI=1S/C17H19NO10/c1-9(19)25-14-8-24-17(16(27-11(3)21)15(14)26-10(2)20)28-13-7-5-4-6-12(13)18(22)23/h4-7,14-17H,8H2,1-3H3/t14-,15+,16-,17+/m1/s1
InChI Key:
RSBQRDKQQIICFV-TWMKSMIVSA-N
SMILES:
CC(=O)O[[email protected]]1[[email protected]@H](OC[[email protected]]([[email protected]@H]1OC(=O)C)OC(=O)C)Oc1ccccc1[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
603  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
397.101g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
397.336g/mol
Monoisotopic Mass:
397.101g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Synonyms
 
10256-24-3 
2-Nitrophenyl 2,3,4-tri-O-acetyl-b-D-xylopyranoside 
o-Nitrophenyl |A-D-Xylopyranoside 2',3',4'-Triacetate, 
o-Nitrophenyl 2-O,3-O,4-O-triacetyl-beta-D-xylopyranoside 
RSBQRDKQQIICFV-TWMKSMIVSA-N 
2-Nitrophenyl beta-D-xylopyranoside 2,3,4-triacetate 
C17H19NO10 
ZINC77311847 
W0150 
W-200669 
2'-Nitrophenyl 2,3,4-Tri-O-acetyl-|A-D-xylopyranoside 
2-Nitrophenyl 2,3,4-tri-O-acetyl-beta-D-xylopyranoside 
beta-D-Xylopyranoside, 2-nitrophenyl, 2,3,4-triacetate 
2-Nitrophenyl 2,3,4-tri-O-acetyl-I(2)-D-xylopyranoside 
Literature
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