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Home > Other Heterocycles > 153493-52-8
153493-52-8 | 5,7-Dioxa-6-thiaspiro[2.5]octane 6,6-dioxide
CAS No: 153493-52-8 Catalog No: AG003A1Z MDL No:MFCD11111986
Product Description
Catalog Number:
AG003A1Z
Chemical Name:
5,7-Dioxa-6-thiaspiro[2.5]octane 6,6-dioxide
CAS Number:
153493-52-8
Molecular Formula:
C5H8O4S
Molecular Weight:
164.1796
MDL Number:
MFCD11111986
IUPAC Name:
5,7-dioxa-6λ6-thiaspiro[2.5]octane 6,6-dioxide
InChI:
InChI=1S/C5H8O4S/c6-10(7)8-3-5(1-2-5)4-9-10/h1-4H2
InChI Key:
JIIABAJOYJJDQW-UHFFFAOYSA-N
SMILES:
O=S1(=O)OCC2(CO1)CC2
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.014g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.175g/mol
Monoisotopic Mass:
164.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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