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159944-99-7 | α-D-Ribofuranoside, methyl 2-C-(trifluoromethyl)-, 3,5-diacetate
CAS No: 159944-99-7 Catalog No: AG001RIQ MDL No:
Product Description
Catalog Number:
AG001RIQ
Chemical Name:
α-D-Ribofuranoside, methyl 2-C-(trifluoromethyl)-, 3,5-diacetate
CAS Number:
159944-99-7
Molecular Formula:
C11H15F3O7
Molecular Weight:
316.2278
IUPAC Name:
[(2R,3R,4R,5S)-3-acetyloxy-4-hydroxy-5-methoxy-4-(trifluoromethyl)oxolan-2-yl]methyl acetate
InChI:
InChI=1S/C11H15F3O7/c1-5(15)19-4-7-8(20-6(2)16)10(17,11(12,13)14)9(18-3)21-7/h7-9,17H,4H2,1-3H3/t7-,8-,9+,10-/m1/s1
InChI Key:
IDTZCXKLMCPWNT-DOLQZWNJSA-N
SMILES:
CO[C@H]1O[C@@H]([C@H]([C@]1(O)C(F)(F)F)OC(=O)C)COC(=O)C
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
316.077g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.229g/mol
Monoisotopic Mass:
316.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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