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Home > Other Heterocycles > 1342380-16-8
1342380-16-8 | 1-oxa-5lambda6-thiaspiro[2.4]heptane-5,5-dione
CAS No: 1342380-16-8 Catalog No: AG01A4T1 MDL No:MFCD18278198
Product Description
Catalog Number:
AG01A4T1
Chemical Name:
1-oxa-5lambda6-thiaspiro[2.4]heptane-5,5-dione
CAS Number:
1342380-16-8
Molecular Formula:
C5H8O3S
Molecular Weight:
148.1802
MDL Number:
MFCD18278198
IUPAC Name:
1-oxa-6λ6-thiaspiro[2.4]heptane 6,6-dioxide
InChI:
InChI=1S/C5H8O3S/c6-9(7)2-1-5(4-9)3-8-5/h1-4H2
InChI Key:
SVQHABNLXQTKQU-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCC2(C1)CO2
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.019g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.176g/mol
Monoisotopic Mass:
148.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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