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Home > Other Heterocycles > 4475-47-2
4475-47-2 | 1,4-dithiaspiro[4.5]decane-2,3-dione
CAS No: 4475-47-2 Catalog No: AG00719B MDL No:
Product Description
Catalog Number:
AG00719B
Chemical Name:
1,4-dithiaspiro[4.5]decane-2,3-dione
CAS Number:
4475-47-2
Molecular Formula:
C8H10O2S2
Molecular Weight:
202.2938
IUPAC Name:
1,4-dithiaspiro[4.5]decane-2,3-dione
InChI:
InChI=1S/C8H10O2S2/c9-6-7(10)12-8(11-6)4-2-1-3-5-8/h1-5H2
InChI Key:
BSXLEFMXFCLZKC-UHFFFAOYSA-N
SMILES:
O=C1SC2(SC1=O)CCCCC2
NSC Number:
160442
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.286g/mol
Monoisotopic Mass:
202.012g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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