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39794-75-7 | Ethyl (p-tosyloxy)acetate
CAS No: 39794-75-7 Catalog No: AG003PZK MDL No:MFCD18252874
Product Description
Catalog Number:
AG003PZK
Chemical Name:
Ethyl (p-tosyloxy)acetate
CAS Number:
39794-75-7
Molecular Formula:
C11H14O5S
Molecular Weight:
258.2909
MDL Number:
MFCD18252874
IUPAC Name:
ethyl 2-(4-methylphenyl)sulfonyloxyacetate
InChI:
InChI=1S/C11H14O5S/c1-3-15-11(12)8-16-17(13,14)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3
InChI Key:
CVNRARCXNKDWKI-UHFFFAOYSA-N
SMILES:
CCOC(=O)COS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.288g/mol
Monoisotopic Mass:
258.056g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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