Methyl 1-hydroxy-2-naphthoate - CAS 948-03-8
Catalog: |
BB041515 |
Product Name: |
Methyl 1-hydroxy-2-naphthoate |
CAS: |
948-03-8 |
Synonyms: |
methyl 1-hydroxynaphthalene-2-carboxylate |
IUPAC Name: | methyl 1-hydroxynaphthalene-2-carboxylate |
Description: | Methyl 1-hydroxy-2-naphthoate (CAS# 948-03-8) is used as a reactant in the preparation of xanthones, thioxanthones, and acridones via intermolecular nucleophilic coupling and intramolecular electrophilic cyclization of substituted benzoates with arynes. |
Molecular Weight: | 202.21 |
Molecular Formula: | C12H10O3 |
Canonical SMILES: | COC(=O)C1=C(C2=CC=CC=C2C=C1)O |
InChI: | InChI=1S/C12H10O3/c1-15-12(14)10-7-6-8-4-2-3-5-9(8)11(10)13/h2-7,13H,1H3 |
InChI Key: | HMIBDRSTVGFJPB-UHFFFAOYSA-N |
Boiling Point: | 330.5 °C at 760 mmHg |
Melting Point: | 76-80 °C (lit.) |
Purity: | 95 % |
Density: | 1.264 g/cm3 |
Storage: | Sealed in dry, Room Temperature |
LogP: | 2.33200 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20200041852-A | Mollugin derivatives, and pharmaceutical composition for preventing or treating inflammatory bowel disease comprising the same | 20200413 |
KR-102223885-B1 | Mollugin derivatives, and pharmaceutical composition for preventing or treating inflammatory bowel disease comprising the same | 20200413 |
JP-2021146667-A | Thermal recording medium and manufacturing method of thermal recording medium | 20200323 |
WO-2021192980-A1 | Thermosensitive recording medium and method for producing thermosensitive recording medium | 20200323 |
WO-2021113806-A1 | Arylamides and methods of use thereof | 20191205 |
PMID | Publication Date | Title | Journal |
21667204 | 20110901 | Methyl-1-hydroxy-2-naphthoate, a novel naphthol derivative, inhibits lipopolysaccharide-induced inflammatory response in macrophages via suppression of NF-κB, JNK and p38 MAPK pathways | Inflammation research : official journal of the European Histamine Research Society ... [et al.] |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.062994177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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