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
-3.4258 -0.1801 0.7674 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4565 0.3266 -0.3746 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3045 -0.6326 -0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5483 -2.0047 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4869 -2.8411 0.1544 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8064 -2.2947 0.2412 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0063 -0.9371 0.0923 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0537 -0.0903 -0.1413 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2252 1.2829 -0.1512 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2904 2.2535 -1.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1316 2.1550 -2.3811 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6127 3.5874 -0.5608 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7298 3.3978 0.7628 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5082 2.0126 1.0863 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5348 1.4576 2.2098 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3651 -0.3237 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0188 -1.1225 1.4097 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3192 -0.7537 -0.9298 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3096 0.0809 -1.6278 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4602 -0.1059 0.4667 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2341 0.5303 1.6364 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1681 -1.1855 1.0905 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1848 1.3362 -0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5200 -2.4332 -0.1557 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5791 -3.8994 0.2871 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6672 -2.9799 0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7494 4.5114 -1.0479 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9742 4.2115 1.4613 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3840 0.7308 0.4026 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9372 -0.5725 1.7505 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3107 -0.9923 2.2838 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1559 -2.1566 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3123 -0.2851 -0.6113 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9831 -0.3940 -1.9089 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4506 -1.8472 -0.8302 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8281 0.4190 -2.5358 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2514 0.6981 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6615 -0.9596 -1.5694 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