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Home > Other Heterocycles > 4580-63-6
4580-63-6 | 1-Thia-4-azaspiro[4.5]decan-3-one
CAS No: 4580-63-6 Catalog No: AG006YOZ MDL No:MFCD00101403
Product Description
Catalog Number:
AG006YOZ
Chemical Name:
1-Thia-4-azaspiro[4.5]decan-3-one
CAS Number:
4580-63-6
Molecular Formula:
C8H13NOS
Molecular Weight:
171.2599
MDL Number:
MFCD00101403
IUPAC Name:
1-thia-4-azaspiro[4.5]decan-3-one
InChI:
InChI=1S/C8H13NOS/c10-7-6-11-8(9-7)4-2-1-3-5-8/h1-6H2,(H,9,10)
InChI Key:
MHTZRDHAPSMSNK-UHFFFAOYSA-N
SMILES:
O=C1CSC2(N1)CCCCC2
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.072g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.258g/mol
Monoisotopic Mass:
171.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| 3-(2H-1,3-Benzodioxol-5-ylmeth-yl)-2-(2-meth-oxy-phen-yl)-1,3-thia-zolidin-4-one. | Acta crystallographica. Section E, Structure reports online 20111101 |
| 4-(Pyrimidin-2-yl)-1-thia-4-aza-spiro-[4.5]decan-3-one. | Acta crystallographica. Section E, Structure reports online 20091201 |
| Synthesis and antituberculosis activity of cycloalkylidenehydrazide and 4-aza-1-thiaspiro[4.5]decan-3-one derivatives of imidazo[2,1-b]thiazole. | Arzneimittel-Forschung 20020101 |
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