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Home > Other Heterocycles > 62826-62-4
62826-62-4 | 1-oxa-5lambda6-thiaspiro[2.5]octane-5,5-dione
CAS No: 62826-62-4 Catalog No: AG01BNKM MDL No:MFCD19653992
Product Description
Catalog Number:
AG01BNKM
Chemical Name:
1-oxa-5lambda6-thiaspiro[2.5]octane-5,5-dione
CAS Number:
62826-62-4
Molecular Formula:
C6H10O3S
Molecular Weight:
162.2068
MDL Number:
MFCD19653992
IUPAC Name:
1-oxa-7λ6-thiaspiro[2.5]octane 7,7-dioxide
InChI:
InChI=1S/C6H10O3S/c7-10(8)3-1-2-6(5-10)4-9-6/h1-5H2
InChI Key:
DCOKRUCYQCJZDL-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCCC2(C1)CO2
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.035g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.203g/mol
Monoisotopic Mass:
162.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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