Monomers
N-(2,6-diisopropylphenyl)maleimide
Identifiers
IUPAC name
1-[2,6-di(propan-2-yl)phenyl]pyrrole-2,5-dione
InchI
InChI=1S/C16H19NO2/c1-10(2)12-6-5-7-13(11(3)4)16(12)17-14(18)8-9-15(17)19/h5-11H,1-4H3
InchI Key
UUOHWLHXGPZSBK-UHFFFAOYSA-N
SMILES
CC(c1cccc(c1N1C(=O)C=CC1=O)C(C)C)C
Canonical SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C=CC2=O
Isomeric SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2C(=O)C=CC2=O
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C16H19NO2
Heavy Atom Count
19
Molecular Weight
257.333
Exact Molecular Weight
257.1416
Valence Electrons
100
Radical Electrons
0
tPSA
37.38
MolLogP
3.3628
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1
MOL File
RDKit 3D
38 39 0 0 0 0 0 0 0 0999 V2000
-3.5971 -0.6385 0.9694 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4699 -0.0318 0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2089 -0.7037 0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2820 -1.9565 1.0728 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1243 -2.6121 1.4003 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0955 -2.0294 1.1465 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1775 -0.7691 0.5558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0255 -0.0908 0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0384 1.2026 -0.3585 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0566 2.4164 0.4244 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1628 2.5078 1.6553 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0102 3.5691 -0.4698 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1020 3.1370 -1.7018 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1363 1.6688 -1.6874 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2369 0.9517 -2.7150 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4964 -0.1496 0.3021 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6077 -0.8469 1.0622 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7953 -0.2051 -1.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8092 -0.2866 -1.3514 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2649 -0.9471 1.9736 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0850 -1.4226 0.3996 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3022 0.2191 1.1606 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4100 1.0536 0.2615 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2125 -2.4690 1.2886 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1115 -3.5962 1.8616 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0431 -2.5172 1.3881 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0561 4.6364 -0.2182 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1642 3.7478 -2.5899 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4468 0.8978 0.6312 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4709 -0.1251 1.1909 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0123 -1.6766 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3279 -1.1352 2.0879 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8750 0.7835 -1.6318 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8108 -0.6866 -1.3345 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0577 -0.8311 -1.7175 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4509 -1.2813 -1.6763 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3853 0.4913 -2.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9208 -0.2748 -1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
8 9 1 0
9 10 1 0
10 11 2 0
10 12 1 0
12 13 2 0
13 14 1 0
14 15 2 0
7 16 1 0
16 17 1 0
16 18 1 0
2 19 1 0
8 3 1 0
14 9 1 0
1 20 1 0
1 21 1 0
1 22 1 0
2 23 1 0
4 24 1 0
5 25 1 0
6 26 1 0
12 27 1 0
13 28 1 0
16 29 1 0
17 30 1 0
17 31 1 0
17 32 1 0
18 33 1 0
18 34 1 0
18 35 1 0
19 36 1 0
19 37 1 0
19 38 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers