4-Chloro-2-methoxybenzoic acid - CAS 57479-70-6
Catalog: |
BB029715 |
Product Name: |
4-Chloro-2-methoxybenzoic acid |
CAS: |
57479-70-6 |
Synonyms: |
4-chloro-2-methoxybenzoic acid |
IUPAC Name: | 4-chloro-2-methoxybenzoic acid |
Description: | 4-Chloro-2-methoxybenzoic acid (CAS# 57479-70-6) is a useful research chemical. |
Molecular Weight: | 186.59 |
Molecular Formula: | C8H7ClO3 |
Canonical SMILES: | COC1=C(C=CC(=C1)Cl)C(=O)O |
InChI: | InChI=1S/C8H7ClO3/c1-12-7-4-5(9)2-3-6(7)8(10)11/h2-4H,1H3,(H,10,11) |
InChI Key: | UFEYMXHWIHFRBX-UHFFFAOYSA-N |
Boiling Point: | 314.7 °C at 760 mmHg |
Density: | 1.352 g/cm3 |
Appearance: | White to light brown crystalline powder |
MDL: | MFCD00002532 |
LogP: | 2.04680 |
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 |
WO-2021204626-A1 | Aryl and heteroaryl-carboxamide substituted heteroaryl compounds as tyk2 inhibitors | 20200406 |
WO-2019002442-A1 | CHEMICAL COMPOUNDS | 20170629 |
KR-101893879-B1 | Novel CDK inhibitory compounds, preparation method thereof, pharmaceutical composition for use in preventing or treating CDK relating diseases containing the same as an active ingredient | 20170331 |
EP-3551634-A1 | Substituted pyrazoloazepin-8-ones and their use as phosphodiesterase inhibitors | 20161212 |
WO-2018108231-A1 | Substituted pyrazoloazepin-8-ones and their use as phosphodiesterase inhibitors | 20161212 |
PMID | Publication Date | Title | Journal |
22690153 | 20120401 | Marinopyrrole derivatives as potential antibiotic agents against methicillin-resistant Staphylococcus aureus (I) | Marine drugs |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0083718 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0083718 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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