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2084-25-5 | 1,2-Oxathiolane, 5-nonyl-, 2,2-dioxide
CAS No: 2084-25-5 Catalog No: AG002JOQ MDL No:
Product Description
Catalog Number:
AG002JOQ
Chemical Name:
1,2-Oxathiolane, 5-nonyl-, 2,2-dioxide
CAS Number:
2084-25-5
Molecular Formula:
C12H24O3S
Molecular Weight:
248.3822
IUPAC Name:
5-nonyloxathiolane 2,2-dioxide
InChI:
InChI=1S/C12H24O3S/c1-2-3-4-5-6-7-8-9-12-10-11-16(13,14)15-12/h12H,2-11H2,1H3
InChI Key:
GFVVEFDOCCGRIS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC1CCS(=O)(=O)O1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.145g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.381g/mol
Monoisotopic Mass:
248.145g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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