7-Methoxy-2-naphthol - CAS 5060-82-2
Catalog: |
BB027137 |
Product Name: |
7-Methoxy-2-naphthol |
CAS: |
5060-82-2 |
Synonyms: |
7-methoxynaphthalen-2-ol |
IUPAC Name: | 7-methoxynaphthalen-2-ol |
Description: | 7-Methoxy-2-naphthol (CAS# 5060-82-2) is used as a reactant in the preparation of 9-hydroxy benzopyrene (H829410). It is also used in the preparation of (pyridyl)naphthalenes as highly potent and selective nonsteroidal dual inhibitors of CYP17/CYP11B2 for the treatment of prostate cancer to reduce risks of cardiovascular diseases. |
Molecular Weight: | 174.20 |
Molecular Formula: | C11H10O2 |
Canonical SMILES: | COC1=CC2=C(C=CC(=C2)O)C=C1 |
InChI: | InChI=1S/C11H10O2/c1-13-11-5-3-8-2-4-10(12)6-9(8)7-11/h2-7,12H,1H3 |
InChI Key: | UNFNRIIETORURP-UHFFFAOYSA-N |
Boiling Point: | 336.7 °C at 760 mmHg |
Melting Point: | 116-119 °C (lit.) |
Purity: | 98 % |
Density: | 1.193 g/cm3 |
MDL: | MFCD00075494 |
LogP: | 2.55400 |
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 |
CN-112999230-A | Application of cryptotanshinone in preparation of bacterial respiratory chain inhibitor | 20210218 |
CN-112679321-A | Green novel method for preparing 1-diarylmethyl substituted-2-naphthol compound | 20210129 |
CN-112574251-A | Preparation method of visible light-promoted 1-phosphonyl-2-naphthol derivative | 20201223 |
CN-111518086-A | Oxoindole-naphthofuran derivatives, preparation method and application thereof, and pharmaceutical composition and preparation containing same | 20200522 |
CN-111518086-B | Oxoindole-naphthofuran derivatives, preparation method and application thereof, and pharmaceutical composition and preparation containing same | 20200522 |
PMID | Publication Date | Title | Journal |
26699277 | 20160101 | Discovery of bicyclic inhibitors against menaquinone biosynthesis | Future medicinal chemistry |
21990014 | 20111104 | Structure-activity relationship for the first-in-class clinical steroid sulfatase inhibitor Irosustat (STX64, BN83495) | ChemMedChem |
19966447 | 20091201 | 4-Methoxy-1-naphthol: chains formed by O-H...O hydrogen bonds and pi-pi stacking interactions | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.068079557 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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