4-Fluoro-3-(methylsulfonyl)benzaldehyde - CAS 914636-50-3
Catalog: |
BB040201 |
Product Name: |
4-Fluoro-3-(methylsulfonyl)benzaldehyde |
CAS: |
914636-50-3 |
Synonyms: |
4-fluoro-3-methylsulfonylbenzaldehyde; 4-fluoro-3-methylsulfonylbenzaldehyde |
IUPAC Name: | 4-fluoro-3-methylsulfonylbenzaldehyde |
Description: | 4-Fluoro-3-(methylsulfonyl)benzaldehyde (CAS# 914636-50-3) is a useful research chemical. |
Molecular Weight: | 202.20 |
Molecular Formula: | C8H7FO3S |
Canonical SMILES: | CS(=O)(=O)C1=C(C=CC(=C1)C=O)F |
InChI: | InChI=1S/C8H7FO3S/c1-13(11,12)8-4-6(5-10)2-3-7(8)9/h2-5H,1H3 |
InChI Key: | FDMWHGMGGVHVLM-UHFFFAOYSA-N |
LogP: | 2.12250 |
Publication Number | Title | Priority Date |
CN-110709396-A | Novel compound inhibitors of the YAP/TAZ-TEAD interaction and their use in the treatment of malignant mesothelioma | 20170406 |
US-2017174688-A1 | Substituted Indoles | 20141218 |
US-2017349589-A9 | Substituted Indoles | 20141218 |
US-9932340-B2 | Substituted indoles | 20141218 |
AU-2015292048-A1 | Compounds | 20140722 |
Complexity: | 280 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.00999342 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.00999342 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 59.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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