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Home > Other Heterocycles > 88370-13-2
88370-13-2 | 2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-(ethoxyimino)butyl]-
CAS No: 88370-13-2 Catalog No: AG004G0Z MDL No:
Product Description
Catalog Number:
AG004G0Z
Chemical Name:
2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-(ethoxyimino)butyl]-
CAS Number:
88370-13-2
Molecular Formula:
C15H23NO3S
Molecular Weight:
297.4130
IUPAC Name:
8-(N-ethoxy-C-propylcarbonimidoyl)-2-thiaspiro[4.5]decane-7,9-dione
InChI:
InChI=1S/C15H23NO3S/c1-3-5-11(16-19-4-2)14-12(17)8-15(9-13(14)18)6-7-20-10-15/h14H,3-10H2,1-2H3
InChI Key:
YOSKDBHWSPRPAG-UHFFFAOYSA-N
SMILES:
CCCC(=NOCC)C1C(=O)CC2(CC1=O)CSCC2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.14g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.413g/mol
Monoisotopic Mass:
297.14g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
81A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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