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1,6-Bismaleimidohexane
CAS: 4856-87-5 | C14H16N2O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4856-87-5
Molecular Formula:
C14H16N2O4
Molecular Mass:
276.29 g/mol
Names and Synonyms:
1,6-Bismaleimidohexane
1H-Pyrrole-2,5-dione, 1,1′-(1,6-hexanediyl)bis-
Maleimide, N,N′-hexamethylenedi-
1,1′-(1,6-Hexanediyl)bis[1H-pyrrole-2,5-dione]
N,N′-Hexamethylenedimaleimide
1,6-Dimaleimidohexane
N,N′-Hexamethylenebis[maleimide]
1,6-Hexamethylenebis[maleimide]
1,6-Bismaleimidohexane
NSC 12818
1,6-Maleimidohexane
GMBMI
1,6-Hexanediylbismaleimide
1,6-Bismaleimidehexane
Hexamethylenediamine bismaleimide
GP 207R
BMH Crosslinker
1,6-BMH
1-[6-(2,5-Dioxopyrrol-1-yl)hexyl]pyrrole-2,5-dione
1,1′-hexane-1,6-diylbis(1H-pyrrole-2,5-dione)
1,1′-(Hexane-1,6-diyl)bis(1H-pyrrole-2,5-dione)
Identifiers:
SMILES:
O=C1C=CC(=O)N1CCCCCCN1C(=O)C=CC1=O
InChI:
InChI=1S/C14H16N2O4/c17-11-5-6-12(18)15(11)9-3-1-2-4-10-16-13(19)7-8-14(16)20/h5-8H,1-4,9-10H2
Key Properties
Melting Point
136-141 °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 | 276.29 g/mol | CAS Common Chemistry |
| 276.29200000000003 g/mol | RDKit | |
| 276.111006992 g/mol | RDKit | |
| Canonical SMILES | O=C1C=CC(=O)N1CCCCCCN2C(=O)C=CC2=O | CAS Common Chemistry |
| InChI | InChI=1S/C14H16N2O4/c17-11-5-6-12(18)15(11)9-3-1-2-4-10-16-13(19)7-8-14(16)20/h5-8H,1-4,9-10H2 | CAS Common Chemistry |
| InChI Key | InChIKey=PYVHLZLQVWXBDZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 136-141 °C | CAS Common Chemistry |
| Name | 1,6-Bismaleimidohexane | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 7 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 74.76 Ų | RDKit |
| LogP | 0.3967999999999998 | RDKit |
| Molar Refractivity | 70.18800000000002 | RDKit |
