3-(5-Fluorothiophen-2-YL)-3-hydroxy-N,N-dimethylbutanamide - CAS 1823437-87-1
Catalog: |
BB052440 |
Product Name: |
3-(5-Fluorothiophen-2-YL)-3-hydroxy-N,N-dimethylbutanamide |
CAS: |
1823437-87-1 |
Synonyms: |
3-(5-Fluoro-2-thienyl)-3-hydroxy-N,N-dimethylbutanamide |
IUPAC Name: | 3-(5-fluorothiophen-2-yl)-3-hydroxy-N,N-dimethylbutanamide |
Molecular Weight: | 231.29 |
Molecular Formula: | C10H14FNO2S |
Canonical SMILES: | CC(CC(=O)N(C)C)(C1=CC=C(S1)F)O |
InChI: | InChI=1S/C10H14FNO2S/c1-10(14,6-9(13)12(2)3)7-4-5-8(11)15-7/h4-5,14H,6H2,1-3H3 |
InChI Key: | AUOYZPKFYOLHQL-UHFFFAOYSA-N |
Purity: | 98% |
Complexity: | 250 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.07292802 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.07292802 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 68.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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