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123163-97-3 | L-Arabinopyranose, 1,2,3,4-tetraacetate
CAS No: 123163-97-3 Catalog No: AG000K3Z MDL No:
Product Description
Catalog Number:
AG000K3Z
Chemical Name:
L-Arabinopyranose, 1,2,3,4-tetraacetate
CAS Number:
123163-97-3
Molecular Formula:
C13H18O9
Molecular Weight:
318.2766
IUPAC Name:
[(3S,4S,5R)-4,5,6-triacetyloxyoxan-3-yl] acetate
InChI:
InChI=1S/C13H18O9/c1-6(14)19-10-5-18-13(22-9(4)17)12(21-8(3)16)11(10)20-7(2)15/h10-13H,5H2,1-4H3/t10-,11-,12+,13?/m0/s1
InChI Key:
MJOQJPYNENPSSS-ACJTYDJDSA-N
SMILES:
CC(=O)O[C@H]1COC([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)C
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
318.095g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.278g/mol
Monoisotopic Mass:
318.095g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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