6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde - CAS 64481-10-3
Catalog: |
BB032476 |
Product Name: |
6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde |
CAS: |
64481-10-3 |
Synonyms: |
6,8-dichloro-4-oxochromene-3-carbaldehyde |
IUPAC Name: | 6,8-dichloro-4-oxochromene-3-carbaldehyde |
Description: | 6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde (CAS# 64481-10-3) is a useful research chemical. |
Molecular Weight: | 243.04 |
Molecular Formula: | C10H4Cl2O3 |
Canonical SMILES: | C1=C(C=C2C(=C1Cl)OC=C(C2=O)C=O)Cl |
InChI: | InChI=1S/C10H4Cl2O3/c11-6-1-7-9(14)5(3-13)4-15-10(7)8(12)2-6/h1-4H |
InChI Key: | IHCCHRKNCOFDAJ-UHFFFAOYSA-N |
Boiling Point: | 396.7 °C at 760 mmHg |
Density: | 1.669 g/cm3 |
MDL: | MFCD00051510 |
LogP: | 2.91230 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2015158895-A1 | Substituted 6, 7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (pde 10a) | 20131205 |
US-2016264549-A1 | Substituted 6, 7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (pde 10a) | 20131205 |
US-9200016-B2 | Substituted 6, 7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (PDE 10A) | 20131205 |
US-9902710-B2 | Substituted 6, 7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (PDE 10A) | 20131205 |
EP-2532664-A1 | Substituted indolo [2,3-a] quinolizines in the treatment of cancer | 20110609 |
PMID | Publication Date | Title | Journal |
18019419 | 20070901 | Biological activity of 3-formylchromones and related compounds | In vivo (Athens, Greece) |
12852966 | 20030804 | Formylchromone derivatives as a novel class of protein tyrosine phosphatase 1B inhibitors | Bioorganic & medicinal chemistry letters |
Complexity: | 327 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.9537494 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.9537494 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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