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78102-17-7 | 1,4-Oxathiane-2,6-diol, cis-
CAS No: 78102-17-7 Catalog No: AG0055DA MDL No:
Product Description
Catalog Number:
AG0055DA
Chemical Name:
1,4-Oxathiane-2,6-diol, cis-
CAS Number:
78102-17-7
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
IUPAC Name:
(2S,6R)-1,4-oxathiane-2,6-diol
InChI:
InChI=1S/C4H8O3S/c5-3-1-8-2-4(6)7-3/h3-6H,1-2H2/t3-,4+
InChI Key:
PQPPCAGZGWTBKK-ZXZARUISSA-N
SMILES:
O[C@@H]1CSC[C@@H](O1)O
Properties
Complexity:
69.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
136.019g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.165g/mol
Monoisotopic Mass:
136.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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