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13897-37-5 | 1,3,2-Dioxathiolane-4-methanol, 2-oxide
CAS No: 13897-37-5 Catalog No: AG0019YF MDL No:MFCD30148775
Product Description
Catalog Number:
AG0019YF
Chemical Name:
1,3,2-Dioxathiolane-4-methanol, 2-oxide
CAS Number:
13897-37-5
Molecular Formula:
C3H6O4S
Molecular Weight:
138.1423
MDL Number:
MFCD30148775
IUPAC Name:
(2-oxo-1,3,2-dioxathiolan-4-yl)methanol
InChI:
InChI=1S/C3H6O4S/c4-1-3-2-6-8(5)7-3/h3-4H,1-2H2
InChI Key:
WIPAUXGFNHDOOK-UHFFFAOYSA-N
SMILES:
OCC1COS(=O)O1
EC Number:
237-665-3
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.999g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.137g/mol
Monoisotopic Mass:
137.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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