1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethanone - CAS 1450657-28-9
Catalog: |
BB072954 |
Product Name: |
1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethanone |
CAS: |
1450657-28-9 |
Synonyms: |
1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethanone; 1-(3-Ethoxy-4-Methoxyphenyl)-2-(Methylsulfonyl) ethanone; 1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethanone; 1-(3-ethoxy-4-methoxy-phenyl)-2-methylsulfonyl-ethanone; 1-(3-ethoxy-4-methoxyphenyl)-2-methanesulfonylethan-1-one |
IUPAC Name: | 1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethanone |
Description: | 1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethanone (cas# 1450657-28-9) is a useful research chemical. |
Molecular Weight: | 272.32 |
Molecular Formula: | C12H16O5S |
Canonical SMILES: | CCOC1=C(C=CC(=C1)C(=O)CS(=O)(=O)C)OC |
InChI: | InChI=1S/C12H16O5S/c1-4-17-12-7-9(5-6-11(12)16-2)10(13)8-18(3,14)15/h5-7H,4,8H2,1-3H3 |
InChI Key: | NDPZMKPHRVBCLF-UHFFFAOYSA-N |
Melting Point: | 141-143°C |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C |
Complexity: | 370 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 272.07184478 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 272.07184478 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 78Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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