Methyl 2-(N-ethylmethanesulfonamido)benzoate - CAS 928708-57-0
Catalog: |
BB059718 |
Product Name: |
Methyl 2-(N-ethylmethanesulfonamido)benzoate |
CAS: |
928708-57-0 |
Synonyms: |
Methyl 2-(N-ethylmethanesulfonamido)benzoate; methyl 2-[ethyl(methylsulfonyl)amino]benzoate; Methyl2-(N-ethylmethanesulfonamido)benzoate |
IUPAC Name: | methyl 2-[ethyl(methylsulfonyl)amino]benzoate |
Description: | Methyl 2-(N-ethylmethanesulfonamido)benzoate |
Molecular Weight: | 257.31 |
Molecular Formula: | C11H15NO4S |
Canonical SMILES: | CCN(C1=CC=CC=C1C(=O)OC)S(=O)(=O)C |
InChI: | InChI=1S/C11H15NO4S/c1-4-12(17(3,14)15)10-8-6-5-7-9(10)11(13)16-2/h5-8H,4H2,1-3H3 |
InChI Key: | CLROIUFAUJYHFY-UHFFFAOYSA-N |
Complexity: | 360 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.07217913 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.07217913 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 72.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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