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Home > Other Heterocycles > 143557-70-4
143557-70-4 | 7,9-Dioxa-8-thiaspiro[4.5]decane, 8,8-dioxide
CAS No: 143557-70-4 Catalog No: AG006UIR MDL No:
Product Description
Catalog Number:
AG006UIR
Chemical Name:
7,9-Dioxa-8-thiaspiro[4.5]decane, 8,8-dioxide
CAS Number:
143557-70-4
Molecular Formula:
C7H12O4S
Molecular Weight:
192.2328
IUPAC Name:
7,9-dioxa-8λ6-thiaspiro[4.5]decane 8,8-dioxide
InChI:
InChI=1S/C7H12O4S/c8-12(9)10-5-7(6-11-12)3-1-2-4-7/h1-6H2
InChI Key:
QWFJNLNITBRUPF-UHFFFAOYSA-N
SMILES:
O=S1(=O)OCC2(CO1)CCCC2
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.046g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.229g/mol
Monoisotopic Mass:
192.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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