Methyl 3-Chloro-4-hydroxybenzoate - CAS 3964-57-6
Catalog: |
BB024072 |
Product Name: |
Methyl 3-Chloro-4-hydroxybenzoate |
CAS: |
3964-57-6 |
Synonyms: |
3-chloro-4-hydroxybenzoic acid methyl ester; methyl 3-chloro-4-hydroxybenzoate |
IUPAC Name: | methyl 3-chloro-4-hydroxybenzoate |
Description: | Methyl 3-Chloro-4-hydroxybenzoate (CAS# 3964-57-6) is a reagent in the preparation of alkylidene hydrazides as human glucagon receptor antagonists for the treatment of hyperglycemia and diabetes. |
Molecular Weight: | 186.59 |
Molecular Formula: | C8H7ClO3 |
Canonical SMILES: | COC(=O)C1=CC(=C(C=C1)O)Cl |
InChI: | InChI=1S/C8H7ClO3/c1-12-8(11)5-2-3-7(10)6(9)4-5/h2-4,10H,1H3 |
InChI Key: | ZSBIMTDWIGWJPW-UHFFFAOYSA-N |
Boiling Point: | 284.9 °C at 760 mmHg |
Density: | 1.354 g/cm3 |
Appearance: | Off white powder |
MDL: | MFCD00016418 |
LogP: | 1.83220 |
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-113354616-A | Diaryl-1, 2, 4-triazole compound, preparation method and pharmaceutical application thereof | 20200305 |
CN-113248492-A | Heterocycle substituted nitrogen-containing six-membered heterocycle derivative, preparation method and medical application thereof | 20200210 |
CN-111171073-A | Preparation method and application of parathion hapten and complete antigen | 20200107 |
WO-2021063404-A1 | Compound as small molecule inhibitor pd-1/pd-l1 and application thereof | 20190930 |
CN-110526881-B | Naphthylamine compound and biologically acceptable salt thereof, and preparation method and application thereof | 20190827 |
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: | 2.3 |
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