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1820-84-4 | β-D-Fructofuranoside, ethyl
CAS No: 1820-84-4 Catalog No: AG00239R MDL No:MFCD20260917
Product Description
Catalog Number:
AG00239R
Chemical Name:
β-D-Fructofuranoside, ethyl
CAS Number:
1820-84-4
Molecular Formula:
C8H16O6
Molecular Weight:
208.2090
MDL Number:
MFCD20260917
IUPAC Name:
(2R,3S,4S,5R)-2-ethoxy-2,5-bis(hydroxymethyl)oxolane-3,4-diol
InChI:
InChI=1S/C8H16O6/c1-2-13-8(4-10)7(12)6(11)5(3-9)14-8/h5-7,9-12H,2-4H2,1H3/t5-,6-,7+,8-/m1/s1
InChI Key:
KQQFKZUGBOQKLW-OOJXKGFFSA-N
SMILES:
CCO[C@]1(CO)O[C@@H]([C@H]([C@@H]1O)O)CO
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
208.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
208.21g/mol
Monoisotopic Mass:
208.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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