4-(2-Methoxyphenyl)aniline - CAS 263901-48-0
Catalog: |
BB019267 |
Product Name: |
4-(2-Methoxyphenyl)aniline |
CAS: |
263901-48-0 |
Synonyms: |
4-(2-methoxyphenyl)aniline; 4-(2-methoxyphenyl)aniline |
IUPAC Name: | 4-(2-methoxyphenyl)aniline |
Description: | 4-(2-Methoxyphenyl)aniline (CAS# 263901-48-0) is used as a reactant in the synthesis of 3-Hydroxypyrimidine-2,4-diones, a selective RNase H inhibitior. |
Molecular Weight: | 199.25 |
Molecular Formula: | C13H13NO |
Canonical SMILES: | COC1=CC=CC=C1C2=CC=C(C=C2)N |
InChI: | InChI=1S/C13H13NO/c1-15-13-5-3-2-4-12(13)10-6-8-11(14)9-7-10/h2-9H,14H2,1H3 |
InChI Key: | VPUUSIRSYXBBJA-UHFFFAOYSA-N |
Boiling Point: | 312.2 ℃ at 760 mmHg |
Density: | 1.1 g/cm3 |
MDL: | MFCD03424683 |
LogP: | 3.52560 |
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-2011151436-A2 | Novel compounds, method for use them and pharmaceutical composition containing them | 20100604 |
CA-2647592-A1 | Inhibitors of polo-like kinases | 20060526 |
EP-2021316-A1 | Inhibitors of polo-like kinases | 20060526 |
JP-2009538833-A | Inhibitors of polo-like kinase | 20060526 |
JP-5437061-B2 | Inhibitors of polo-like kinase | 20060526 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.099714038 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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