2,3-Dihydroxynaphthalene - CAS 92-44-4
Catalog: |
BB040514 |
Product Name: |
2,3-Dihydroxynaphthalene |
CAS: |
92-44-4 |
Synonyms: |
naphthalene-2,3-diol |
IUPAC Name: | naphthalene-2,3-diol |
Description: | 2,3-Dihydroxynaphthalene (CAS# 92-44-4) is a metabolite of Acetochlor (A162500), which is a chloroacetanilide related herbicide that inhibits elongase and geranylgeranyl pyrophosphate (GGPP) cyclization enzymes. Drinking water contaminant candidate list 3 (CCL 3) compound as per United States Environmental Protection Agency (EPA), environmental, and food contaminants. |
Molecular Weight: | 160.17 |
Molecular Formula: | C10H8O2 |
Canonical SMILES: | C1=CC=C2C=C(C(=CC2=C1)O)O |
InChI: | InChI=1S/C10H8O2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6,11-12H |
InChI Key: | JRNGUTKWMSBIBF-UHFFFAOYSA-N |
Boiling Point: | 354 °C |
Melting Point: | 162-166 °C |
Purity: | 95 % |
Density: | 1.12 g/cm3 |
Appearance: | Off white to grey powder |
Storage: | Store in a cool, dry place. Store in a tightly closed container. |
LogP: | 2.25100 |
Vapor Pressure: | 0.00000715 [mmHg] |
GHS Hazard Statement: | H302 (10.64%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113461932-A | Preparation method of polyaryletherketone | 20210729 |
CN-112679321-A | Green novel method for preparing 1-diarylmethyl substituted-2-naphthol compound | 20210129 |
CN-112490477-A | Aqueous all-organic mixed liquid flow battery based on conjugated microporous polymer negative electrode containing redox active side group unit | 20201127 |
JP-2021047979-A | Magnetic powder, method for producing magnetic powder, and magnetic recording medium | 20201127 |
JP-2021009752-A | Magnetic recording medium and magnetic recording / playback device | 20201029 |
PMID | Publication Date | Title | Journal |
29094189 | 20180201 | Comparative developmental toxicity of a comprehensive suite of polycyclic aromatic hydrocarbons | Archives of toxicology |
23684558 | 20130901 | Comparative developmental toxicity of environmentally relevant oxygenated PAHs | Toxicology and applied pharmacology |
22691976 | 20120728 | The syntheses and characterizations of molybdenum(VI) complexes with catechol and 2,3-dihydroxynaphthalene, and the structure-effect relationship in their in vitro anticancer activities | Dalton transactions (Cambridge, England : 2003) |
23016299 | 20120601 | [Simultaneous determination of seven naphthalenediols in cosmetics by reversed-phase high performance liquid chromatography] | Se pu = Chinese journal of chromatography |
22465938 | 20120514 | A novel 'pro-sensitizer' based sensing of enzymes using Tb(III) luminescence in a hydrogel matrix | Chemical communications (Cambridge, England) |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.052429494 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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