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Home > Other Heterocycles > 113194-32-4
113194-32-4 | 1,4-Dioxa-7-thiaspiro[4.5]dec-8-ene
CAS No: 113194-32-4 Catalog No: AG007APJ MDL No:
Product Description
Catalog Number:
AG007APJ
Chemical Name:
1,4-Dioxa-7-thiaspiro[4.5]dec-8-ene
CAS Number:
113194-32-4
Molecular Formula:
C7H10O2S
Molecular Weight:
158.2181
IUPAC Name:
1,4-dioxa-9-thiaspiro[4.5]dec-7-ene
InChI:
InChI=1S/C7H10O2S/c1-2-7(6-10-5-1)8-3-4-9-7/h1,5H,2-4,6H2
InChI Key:
ACLCEKXQCVDXFS-UHFFFAOYSA-N
SMILES:
C1=CCC2(CS1)OCCO2
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.215g/mol
Monoisotopic Mass:
158.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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