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Molecule
Tetraglycidyl 4,4′-Diaminodiphenylmethane
CAS: 28768-32-3 · C25H30N2O4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 28768-32-3
- Molecular Formula
- C25H30N2O4
- Molecular Mass
- 422.53 g/mol
Identifiers
CAS Registry Number
28768-32-3
SMILES
c1cc(N(CC2CO2)CC2CO2)ccc1Cc1ccc(N(CC2CO2)CC2CO2)cc1
InChI Key
FAUAZXVRLVIARB-UHFFFAOYSA-N
InChI
InChI=1S/C25H30N2O4/c1-5-20(26(10-22-14-28-22)11-23-15-29-23)6-2-18(1)9-19-3-7-21(8-4-19)27(12-24-16-30-24)13-25-17-31-25/h1-8,22-25H,9-17H2
Names and Synonyms
- Tetraglycidyl 4,4′-Diaminodiphenylmethane Systematic Name
- 2-Oxiranemethanamine, N,N′-(methylenedi-4,1-phenylene)bis[N-(2-oxiranylmethyl)- Synonym
- Oxiranemethanamine, N,N′-(methylenedi-4,1-phenylene)bis[N-(oxiranylmethyl)- Synonym
- Aniline, 4,4′-methylenebis[N,N-bis(2,3-epoxypropyl)- Synonym
- N,N′-(Methylenedi-4,1-phenylene)bis[N-(2-oxiranylmethyl)-2-oxiranemethanamine] Synonym
- Bis[4-(diglycidylamino)phenyl]methane Synonym
- N,N,N′,N′-Tetraglycidylbis(p-aminophenyl)methane Synonym
- Tetraglycidyl methylenedianiline Synonym
- Tetraglycidyl 4,4′-diaminodiphenylmethane Synonym
- 4,4′-Methylenebis[N,N-diglycidylaniline] Synonym
- N,N,N′,N′-Tetraglycidyl-4,4′-diaminodiphenylmethane Synonym
- N,N,N′,N′-Tetraglycidyl-4,4′-methylenebisbenzenamine Synonym
- N,N,N′,N′-Tetraglycidyl-4,4′-methylenedianiline Synonym
- 4,4′-Methylenebis[N,N-bis(oxiranylmethyl)aniline] Synonym
- 4,4′-Methylenedianiline tetraglycidyl ether Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 422.53 g/mol | CAS Common Chemistry |
| 422.52500000000026 g/mol | RDKit | |
| 422.525 g/mol | RDKit | |
| Canonical SMILES | O1CC1CN(C2=CC=C(C=C2)CC3=CC=C(C=C3)N(CC4OC4)CC5OC5)CC6OC6 | CAS Common Chemistry |
| InChI | InChI=1S/C25H30N2O4/c1-5-20(26(10-22-14-28-22)11-23-15-29-23)6-2-18(1)9-19-3-7-21(8-4-19)27(12-24-16-30-24)13-25-17-31-25/h1-8,22-25H,9-17H2 | CAS Common Chemistry |
| InChI Key | InChIKey=FAUAZXVRLVIARB-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Tetraglycidyl 4,4′-diaminodiphenylmethane | CAS Common Chemistry |
| Heavy Atom Count | 31 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 12 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 56.6 Ų | RDKit |
| LogP | 2.4854000000000003 | RDKit |
| 2.4854 | RDKit | |
| Molar Refractivity | 119.07600000000004 cm³/mol | RDKit |
| Ring Count | 6 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.52 | RDKit |
| Exact Mass | 422.22055743999994 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 422.53 g/mol. Edit any field — others recompute live.
