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Home Sulfos 1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate

1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate

CAS No.:
23511-05-9
Catalog Number:
AG00BIGX
Molecular Formula:
C15H20O5S
Molecular Weight:
312.3813
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00BIGX
Chemical Name:
1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
CAS Number:
23511-05-9
Molecular Formula:
C15H20O5S
Molecular Weight:
312.3813
MDL Number:
MFCD18429461
IUPAC Name:
1,4-dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
InChI:
InChI=1S/C15H20O5S/c1-12-2-4-14(5-3-12)21(16,17)20-13-6-8-15(9-7-13)18-10-11-19-15/h2-5,13H,6-11H2,1H3
InChI Key:
OWOKCUXVMOFUSP-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)OC1CCC2(CC1)OCCO2
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.103g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.38g/mol
Monoisotopic Mass:
312.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties