4,4'-Dimethoxydiphenylamine - CAS 101-70-2
Catalog: |
BB000611 |
Product Name: |
4,4'-Dimethoxydiphenylamine |
CAS: |
101-70-2 |
Synonyms: |
4-methoxy-N-(4-methoxyphenyl)aniline; 4-methoxy-N-(4-methoxyphenyl)aniline |
IUPAC Name: | 4-methoxy-N-(4-methoxyphenyl)aniline |
Description: | 4,4'-Dimethoxydiphenylamine (CAS# 101-70-2) is a diphenylamine derivative used as a chemical additive for cured rubber. 4,4'-Dimethoxydiphenylamine is highly toxic and may potentially induce chromosome abberation. |
Molecular Weight: | 229.27 |
Molecular Formula: | C14H15NO2 |
Canonical SMILES: | COC1=CC=C(C=C1)NC2=CC=C(C=C2)OC |
InChI: | InChI=1S/C14H15NO2/c1-16-13-7-3-11(4-8-13)15-12-5-9-14(17-2)10-6-12/h3-10,15H,1-2H3 |
InChI Key: | VCOONNWIINSFBA-UHFFFAOYSA-N |
Boiling Point: | 371.1 °C / 760 mmHg |
Density: | 1.126 g/cm3 |
Solubility: | less than 1 mg/mL at 66 °F |
Appearance: | 4,4'-dimethoxydiphenylamine is a fine very light gray to silver-gray crystalline solid. |
Storage: | Keep in dark place. Inert atmosphere. Room temperature. |
MDL: | MFCD00014895 |
LogP: | 3.52040 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P201, P202, P261, P264, P271, P280, P281, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021080483-A | Complex | 20210304 |
CN-113087726-A | Arylamine organic semiconductor material and application thereof in photoelectric device | 20210224 |
CN-112500390-A | Organic hole transport material, synthesis method thereof and perovskite battery | 20201120 |
JP-2021009392-A | Optically anisotropic film | 20200908 |
WO-2021197968-A1 | Thermal management system | 20200330 |
PMID | Publication Date | Title | Journal |
22791585 | 20120801 | Diketopyrrolopyrrole-porphyrin conjugates as broadly absorbing sensitizers for dye-sensitized solar cells | ChemSusChem |
20397715 | 20100517 | Redox-active tripodal aminetris(aryloxide) complexes of titanium(IV) | Inorganic chemistry |
14531693 | 20031015 | Intervalence near-IR spectra of delocalized dinitroaromatic radical anions | Journal of the American Chemical Society |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.110278721 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 30.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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