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144465-02-1 | 1,3,2-Dioxathiolane, 4-hexyl-, 2,2-dioxide
CAS No: 144465-02-1 Catalog No: AG001JL7 MDL No:
Product Description
Catalog Number:
AG001JL7
Chemical Name:
1,3,2-Dioxathiolane, 4-hexyl-, 2,2-dioxide
CAS Number:
144465-02-1
Molecular Formula:
C8H16O4S
Molecular Weight:
208.2752
IUPAC Name:
4-hexyl-1,3,2-dioxathiolane 2,2-dioxide
InChI:
InChI=1S/C8H16O4S/c1-2-3-4-5-6-8-7-11-13(9,10)12-8/h8H,2-7H2,1H3
InChI Key:
KDKIUURUGXCGJA-UHFFFAOYSA-N
SMILES:
CCCCCCC1COS(=O)(=O)O1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.272g/mol
Monoisotopic Mass:
208.077g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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