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Home > Pyridines > 1909316-44-4
1909316-44-4 | 2-(pyridin-3-yl)oxan-4-yl methanesulfonate
CAS No: 1909316-44-4 Catalog No: AG01C25U MDL No:MFCD29054921
Product Description
Catalog Number:
AG01C25U
Chemical Name:
2-(pyridin-3-yl)oxan-4-yl methanesulfonate
CAS Number:
1909316-44-4
Molecular Formula:
C11H15NO4S
Molecular Weight:
257.3061
MDL Number:
MFCD29054921
IUPAC Name:
(2-pyridin-3-yloxan-4-yl) methanesulfonate
InChI:
InChI=1S/C11H15NO4S/c1-17(13,14)16-10-4-6-15-11(7-10)9-3-2-5-12-8-9/h2-3,5,8,10-11H,4,6-7H2,1H3
InChI Key:
JUGMMBDKWSSRMS-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)OC1CCOC(C1)c1cccnc1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.304g/mol
Monoisotopic Mass:
257.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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