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183506-73-2 | D-Galactopyranose, 4-deoxy-4-fluoro-, tetraacetate (9CI)
CAS No: 183506-73-2 Catalog No: AG0027MM MDL No:
Product Description
Catalog Number:
AG0027MM
Chemical Name:
D-Galactopyranose, 4-deoxy-4-fluoro-, tetraacetate (9CI)
CAS Number:
183506-73-2
Molecular Formula:
C14H19FO9
Molecular Weight:
350.2937
IUPAC Name:
[(2R,3S,4R,5R)-4,5,6-triacetyloxy-3-fluorooxan-2-yl]methyl acetate
InChI:
InChI=1S/C14H19FO9/c1-6(16)20-5-10-11(15)12(21-7(2)17)13(22-8(3)18)14(24-10)23-9(4)19/h10-14H,5H2,1-4H3/t10-,11+,12+,13-,14?/m1/s1
InChI Key:
DPGJKBANJUBLLX-RRYROLNDSA-N
SMILES:
CC(=O)OC[C@H]1OC(OC(=O)C)[C@@H]([C@H]([C@H]1F)OC(=O)C)OC(=O)C
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
350.101g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.295g/mol
Monoisotopic Mass:
350.101g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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