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10256-24-3 | β-D-Xylopyranoside, 2-nitrophenyl, 2,3,4-triacetate
CAS No: 10256-24-3 Catalog No: AG0007PR MDL No:MFCD07369611
Product Description
Catalog Number:
AG0007PR
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[C@H]1[C@@H](OC[C@H]([C@@H]1OC(=O)C)OC(=O)C)Oc1ccccc1[N+](=O)[O-]
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
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