2,5-Dimethoxyaniline - CAS 102-56-7
Catalog: |
BB000889 |
Product Name: |
2,5-Dimethoxyaniline |
CAS: |
102-56-7 |
Synonyms: |
2,5-dimethoxyaniline |
IUPAC Name: | 2,5-dimethoxyaniline |
Description: | 2,5-Dimethoxyaniline (CAS# 102-56-7) is a useful building block, used in the preparation of indole derivatives as Dengue virus inhibitors. As an analyte, 2,5-Dimethoxyaniline is used in the determination of metoclopramide hydrochloride in bulk and pharmaceutical preparations by diazotization-coupling reactions. |
Molecular Weight: | 153.18 |
Molecular Formula: | C8H11NO2 |
Canonical SMILES: | COC1=CC(=C(C=C1)OC)N |
InChI: | InChI=1S/C8H11NO2/c1-10-6-3-4-8(11-2)7(9)5-6/h3-5H,9H2,1-2H3 |
InChI Key: | NAZDVUBIEPVUKE-UHFFFAOYSA-N |
Boiling Point: | 140 °C (7 mmHg) |
Density: | 1407 g/cm3 |
Appearance: | Grey to dark brown crystalline powder or lumps |
MDL: | MFCD00008368 |
LogP: | 1.86720 |
Vapor Pressure: | 0.00828 [mmHg] |
GHS Hazard Statement: | H301 (55.56%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P312, P314, P321, P322, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
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CN-112079734-A | Preparation method of 4-chloro-2, 5-dimethoxyaniline | 20200930 |
CN-111978314-A | Preparation method of secondary amine compound containing thiazole ring | 20200827 |
CN-111777592-A | N4- (2, 5-dimethoxyphenyl) -pyrimidinediamine targeted DDR1 inhibitor and preparation and application thereof | 20200622 |
PMID | Publication Date | Title | Journal |
22155433 | 20120101 | Development of quantitative enzymatic method and its validation for the assay of glucose in human serum | Clinical biochemistry |
21866924 | 20111007 | Synthesis of amino-1,4-benzoquinones and their use in Diels-Alder approaches to the aminonaphthoquinone antibiotics | The Journal of organic chemistry |
22058755 | 20111001 | N-(4-Chloro-butano-yl)-N'-(2,5-dimeth-oxy-phen-yl)thio-urea | Acta crystallographica. Section E, Structure reports online |
20060202 | 20100401 | New isatin derivatives with antioxidant activity | European journal of medicinal chemistry |
19336272 | 20090601 | Electrochemical detection of glyphosate herbicide using horseradish peroxidase immobilized on sulfonated polymer matrix | Bioelectrochemistry (Amsterdam, Netherlands) |
Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.078978594 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 44.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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