2,5-Dichlorohydroquinone - CAS 824-69-1
Catalog: |
BB036838 |
Product Name: |
2,5-Dichlorohydroquinone |
CAS: |
824-69-1 |
Synonyms: |
2,5-dichlorobenzene-1,4-diol |
IUPAC Name: | 2,5-dichlorobenzene-1,4-diol |
Description: | 2,5-Dichlorohydroquinone (CAS# 824-69-1 ) is a useful research chemical. |
Molecular Weight: | 179.00 |
Molecular Formula: | C6H4Cl2O2 |
Canonical SMILES: | C1=C(C(=CC(=C1Cl)O)Cl)O |
InChI: | InChI=1S/C6H4Cl2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,9-10H |
InChI Key: | AYNPIRVEWMUJDE-UHFFFAOYSA-N |
Boiling Point: | 274 °C at 760 mmHg |
Density: | 1.624 g/cm3 |
Appearance: | Almost white to pink-brown crystalline powder |
MDL: | MFCD00041749 |
LogP: | 2.40460 |
GHS Hazard Statement: | H314 (90.48%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
22179583 | 20120101 | The whole genome sequence of Sphingobium chlorophenolicum L-1: insights into the evolution of the pentachlorophenol degradation pathway | Genome biology and evolution |
22701692 | 20120101 | Metabolism of 2-chloro-4-nitrophenol in a gram negative bacterium, Burkholderia sp. RKJ 800 | PloS one |
22035794 | 20111028 | Identification of a eukaryotic reductive dechlorinase and characterization of its mechanism of action on its natural substrate | Chemistry & biology |
21389627 | 20110101 | The lin genes for γ-hexachlorocyclohexane degradation in Sphingomonas sp. MM-1 proved to be dispersed across multiple plasmids | Bioscience, biotechnology, and biochemistry |
21579564 | 20100529 | 2-[(2,4-Dihydroxy-benzyl-idene)amino]-3',6'-bis-(ethyl-amino)spiro-[isoindoline-1,9'-xanthen]-3-one | Acta crystallographica. Section E, Structure reports online |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.9588348 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.9588348 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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