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Bis(4-Methoxyphenyl)Amine
CAS: 101-70-2 | C14H15NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
101-70-2
Molecular Formula:
C14H15NO2
Molecular Mass:
229.28 g/mol
Names and Synonyms:
Bis(4-Methoxyphenyl)Amine
Benzenamine, 4-methoxy-N-(4-methoxyphenyl)-
Diphenylamine, 4,4′-dimethoxy-
4-Methoxy-N-(4-methoxyphenyl)benzenamine
p,p′-Dimethoxydiphenylamine
4,4′-Dimethoxydiphenylamine
Di(p-methoxyphenyl)amine
N-(p-Methoxyphenyl)-p-anisidine
Bis(p-methoxyphenyl)amine
Di-p-anisylamine
Bis(p-anisyl)amine
Difenam
Bis(4-methoxyphenyl)amine
Thermoflex
Fenam M
N,N-Bis(4-methoxyphenyl)amine
N-(4-Methoxyphenyl)-p-anisidine
Di(4-methoxyphenyl)amine
Identifiers:
SMILES:
COc1ccc(Nc2ccc(OC)cc2)cc1
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
Key Properties
Boiling Point
250-255 °C @ Press: 15 Torr
CAS Common Chemistry
Melting Point
103 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 229.28 g/mol | CAS Common Chemistry |
| 229.279 g/mol | RDKit | |
| 229.11027872 g/mol | RDKit | |
| Boiling Point | 250-255 °C @ Press: 15 Torr | CAS Common Chemistry |
| Canonical SMILES | O(C1=CC=C(C=C1)NC2=CC=C(OC)C=C2)C | CAS Common Chemistry |
| 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 | CAS Common Chemistry |
| InChI Key | InChIKey=VCOONNWIINSFBA-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 103 °C | CAS Common Chemistry |
| Name | Bis(4-methoxyphenyl)amine | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 30.49 Ų | RDKit |
| LogP | 3.447400000000002 | RDKit |
| Molar Refractivity | 69.27070000000003 | RDKit |
