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Home > Other Heterocycles > 88370-14-3
88370-14-3 | 2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-[(2-propenyloxy)imino]butyl]-
CAS No: 88370-14-3 Catalog No: AG004MCI MDL No:
Product Description
Catalog Number:
AG004MCI
Chemical Name:
2-Thiaspiro[4.5]decane-7,9-dione, 8-[1-[(2-propenyloxy)imino]butyl]-
CAS Number:
88370-14-3
Molecular Formula:
C16H23NO3S
Molecular Weight:
309.4237
IUPAC Name:
8-(N-prop-2-enoxy-C-propylcarbonimidoyl)-2-thiaspiro[4.5]decane-7,9-dione
InChI:
InChI=1S/C16H23NO3S/c1-3-5-12(17-20-7-4-2)15-13(18)9-16(10-14(15)19)6-8-21-11-16/h4,15H,2-3,5-11H2,1H3
InChI Key:
IKIINBMWKDHSOV-UHFFFAOYSA-N
SMILES:
CCCC(=NOCC=C)C1C(=O)CC2(CC1=O)CSCC2
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.14g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.424g/mol
Monoisotopic Mass:
309.14g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
81A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.5
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