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5328-63-2 | (2R,3S,4R,5R);-2-Methoxytetrahydro-2H-pyran-3,4,5-triol
CAS No: 5328-63-2 Catalog No: AG003S3G MDL No:MFCD00204308
Product Description
Catalog Number:
AG003S3G
Chemical Name:
(2R,3S,4R,5R);-2-Methoxytetrahydro-2H-pyran-3,4,5-triol
CAS Number:
5328-63-2
Molecular Formula:
C6H12O5
Molecular Weight:
164.1565
MDL Number:
MFCD00204308
IUPAC Name:
(2R,3S,4R,5R)-2-methoxyoxane-3,4,5-triol
InChI:
InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(7)2-11-6/h3-9H,2H2,1H3/t3-,4-,5+,6-/m1/s1
InChI Key:
ZBDGHWFPLXXWRD-ARQDHWQXSA-N
SMILES:
CO[C@@H]1OC[C@H]([C@H]([C@@H]1O)O)O
EC Number:
226-215-1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
164.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
164.157g/mol
Monoisotopic Mass:
164.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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