4'-Hydroxybutyrophenone - CAS 1009-11-6
Catalog: |
BB000385 |
Product Name: |
4'-Hydroxybutyrophenone |
CAS: |
1009-11-6 |
Synonyms: |
1-(4-hydroxyphenyl)-1-butanone; 1-(4-hydroxyphenyl)butan-1-one |
IUPAC Name: | 1-(4-hydroxyphenyl)butan-1-one |
Description: | 4'-Hydroxybutyrophenone (CAS# 1009-11-6) is a useful research chemical. |
Molecular Weight: | 164.20 |
Molecular Formula: | C10H12O2 |
Canonical SMILES: | CCCC(=O)C1=CC=C(C=C1)O |
InChI: | InChI=1S/C10H12O2/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7,11H,2-3H2,1H3 |
InChI Key: | GFBLPULLSAPXDC-UHFFFAOYSA-N |
Boiling Point: | 311.5 °C at 760 mmHg |
Density: | 1.077 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00020173 |
LogP: | 2.37500 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021188786-A1 | Substituted 1,2,4-triazoles and methods of use | 20191218 |
CN-110872323-A | Calix [6] arene derivative, complex and hydroformylation method of olefin | 20191128 |
WO-2020255984-A1 | Composition for forming resist underlayer film capable of wet etching, containing heterocyclic compound having dicyanostyryl group | 20190617 |
WO-2019238816-A1 | Bifunctional molecules for targeting uchl5 | 20180613 |
WO-2019238886-A1 | Bifunctional molecules for targeting usp14 | 20180613 |
PMID | Publication Date | Title | Journal |
17408723 | 20070801 | Anaerobic biodegradation of 4-alkylphenols in a paddy soil microcosm supplemented with nitrate | Chemosphere |
16797984 | 20060901 | Synthesis, biochemical evaluation and rationalisation of the inhibitory activity of a series of 4-hydroxyphenyl ketones as potential inhibitors of 17beta-hydroxysteroid dehydrogenase type 3 (17beta-HSD3) | Bioorganic & medicinal chemistry letters |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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