2',4'-Dichloro-2-hydroxyacetophenone - CAS 137958-96-4
Catalog: |
BB008690 |
Product Name: |
2',4'-Dichloro-2-hydroxyacetophenone |
CAS: |
137958-96-4 |
Synonyms: |
1-(2,4-dichlorophenyl)-2-hydroxyethanone; 1-(2,4-dichlorophenyl)-2-hydroxyethanone |
IUPAC Name: | 1-(2,4-dichlorophenyl)-2-hydroxyethanone |
Description: | 2',4'-Dichloro-2-hydroxyacetophenone (CAS# 137958-96-4 ) is a useful research chemical. |
Molecular Weight: | 205.04 |
Molecular Formula: | C8H6Cl2O2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)Cl)C(=O)CO |
InChI: | InChI=1S/C8H6Cl2O2/c9-5-1-2-6(7(10)3-5)8(12)4-11/h1-3,11H,4H2 |
InChI Key: | QDLQMALYLVMPTR-UHFFFAOYSA-N |
LogP: | 2.16840 |
Publication Number | Title | Priority Date |
JP-2014205651-A | Production method of ester compound | 20130416 |
WO-2014010752-A1 | METHOD FOR PRODUCING α-HYDROXYCARBOXYLIC ACID ESTER | 20120713 |
JP-2013177360-A | METHOD FOR PRODUCING α-KETOALDEHYDE COMPOUND | 20110802 |
WO-2013018626-A1 | Method for producing alpha-ketoaldehyde compound | 20110802 |
EP-0765314-A1 | Benzoheterocyclic derivatives useful as vasopressin or oxytocin modulators | 19940615 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.9744848 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.9744848 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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