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88370-12-1 | 2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-[(2-propenyloxy)imino]propyl]-
CAS No: 88370-12-1 Catalog No: AG004MCJ MDL No:
Product Description
Catalog Number:
AG004MCJ
Chemical Name:
2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-[(2-propenyloxy)imino]propyl]-
CAS Number:
88370-12-1
Molecular Formula:
C15H21NO3S
Molecular Weight:
295.3971
IUPAC Name:
8-(C-ethyl-N-prop-2-enoxycarbonimidoyl)-2-thiaspiro[4.5]decane-7,9-dione
InChI:
InChI=1S/C15H21NO3S/c1-3-6-19-16-11(4-2)14-12(17)8-15(9-13(14)18)5-7-20-10-15/h3,14H,1,4-10H2,2H3
InChI Key:
XUHCBZIDLVVOFC-UHFFFAOYSA-N
SMILES:
C=CCON=C(C1C(=O)CC2(CC1=O)CSCC2)CC
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.124g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.397g/mol
Monoisotopic Mass:
295.124g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
81A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.2
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