2,5-Dimethoxybenzylamine - CAS 3275-95-4
Catalog: |
BB021399 |
Product Name: |
2,5-Dimethoxybenzylamine |
CAS: |
3275-95-4 |
Synonyms: |
(2,5-dimethoxyphenyl)methanamine |
IUPAC Name: | (2,5-dimethoxyphenyl)methanamine |
Description: | 2,5-Dimethoxybenzylamine (CAS# 3275-95-4) is used in the preparation of pyrrolo[2,3-b]pyrazine-7-carboxamide derivatives as JAK and SYK inhibitors for the treatment of autoimmune and inflammatory diseases. |
Molecular Weight: | 167.21 |
Molecular Formula: | C9H13NO2 |
Canonical SMILES: | COC1=CC(=C(C=C1)OC)CN |
InChI: | InChI=1S/C9H13NO2/c1-11-8-3-4-9(12-2)7(5-8)6-10/h3-5H,6,10H2,1-2H3 |
InChI Key: | UWMCHDDHXMFKMA-UHFFFAOYSA-N |
Boiling Point: | 88-90 ℃ (0.2 mmHg) |
Purity: | 95 % |
Density: | 1.11 g/cm3 |
Appearance: | Colorless to light yellow liqui |
Storage: | Store under Nitrogen |
MDL: | MFCD00052811 |
LogP: | 1.86280 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111635334-A | Method for generating nitrile by catalyzing primary amine acceptor-free dehydrogenation through Ru complex | 20200713 |
WO-2019152685-A1 | Spiro-lactam nmda receptor modulators and methods of using same | 20180131 |
US-10961296-B2 | Modified ligand-gated ion channels and methods of use | 20171110 |
ES-2710544-A1 | New pyrazolone-like compounds for the diagnosis of allergies to beta-lactam antibiotics (Machine-translation by Google Translate, not legally binding) | 20171020 |
WO-2019077190-A1 | NOVEL PYRAZOLONE COMPOUNDS FOR THE DIAGNOSIS OF ALLERGIES TO BEETACHETIC ANTIBIOTICS | 20171020 |
PMID | Publication Date | Title | Journal |
18771252 | 20081009 | N9-substituted 2,4-diaminoquinazolines: synthesis and biological evaluation of lipophilic inhibitors of pneumocystis carinii and toxoplasma gondii dihydrofolate reductase | Journal of medicinal chemistry |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.094628657 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 44.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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