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Home > Other Heterocycles > 2059939-64-7
2059939-64-7 | 5-(benzenesulfonyl)-1-oxaspiro[2.3]hexane
CAS No: 2059939-64-7 Catalog No: AG01BZM6 MDL No:MFCD30488550
Product Description
Catalog Number:
AG01BZM6
Chemical Name:
5-(benzenesulfonyl)-1-oxaspiro[2.3]hexane
CAS Number:
2059939-64-7
Molecular Formula:
C11H12O3S
Molecular Weight:
224.2762
MDL Number:
MFCD30488550
IUPAC Name:
5-(benzenesulfonyl)-1-oxaspiro[2.3]hexane
InChI:
InChI=1S/C11H12O3S/c12-15(13,9-4-2-1-3-5-9)10-6-11(7-10)8-14-11/h1-5,10H,6-8H2
InChI Key:
WSBRBTUJUAMPSV-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)C1CC2(C1)OC2
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.274g/mol
Monoisotopic Mass:
224.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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