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15886-83-6 | 1,8-Octanediol, 1,8-dimethanesulfonate
CAS No: 15886-83-6 Catalog No: AG001QYL MDL No:
Product Description
Catalog Number:
AG001QYL
Chemical Name:
1,8-Octanediol, 1,8-dimethanesulfonate
CAS Number:
15886-83-6
Molecular Formula:
C10H22O6S2
Molecular Weight:
302.4081
IUPAC Name:
8-methylsulfonyloxyoctyl methanesulfonate
InChI:
InChI=1S/C10H22O6S2/c1-17(11,12)15-9-7-5-3-4-6-8-10-16-18(2,13)14/h3-10H2,1-2H3
InChI Key:
ZMIHCVPWXMOTIF-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)OCCCCCCCCOS(=O)(=O)C
NSC Number:
176051
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.086g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.4g/mol
Monoisotopic Mass:
302.086g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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