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Home > Fluorides > 1308644-71-4
1308644-71-4 | 3-Oxetanemethanol, 3-fluoro-, 3-(4-methylbenzenesulfonate)
CAS No: 1308644-71-4 Catalog No: AG000V0M MDL No:MFCD14706189
Product Description
Catalog Number:
AG000V0M
Chemical Name:
3-Oxetanemethanol, 3-fluoro-, 3-(4-methylbenzenesulfonate)
CAS Number:
1308644-71-4
Molecular Formula:
C11H13FO4S
Molecular Weight:
260.2819
MDL Number:
MFCD14706189
IUPAC Name:
(3-fluorooxetan-3-yl)methyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C11H13FO4S/c1-9-2-4-10(5-3-9)17(13,14)16-8-11(12)6-15-7-11/h2-5H,6-8H2,1H3
InChI Key:
VKVRJIRYDHEVTB-UHFFFAOYSA-N
SMILES:
FC1(COS(=O)(=O)c2ccc(cc2)C)COC1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.052g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.279g/mol
Monoisotopic Mass:
260.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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