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
3.4739 -1.2733 -0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3813 -0.4622 -0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0352 -1.1533 -0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9818 -2.4926 -0.1282 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2475 -3.0774 0.1165 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3669 -2.2438 0.2487 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3010 -0.8726 0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0639 -0.2834 -0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0546 1.0901 -0.1405 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0548 1.9795 0.9933 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0601 1.6357 2.1919 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2219 3.3404 0.4868 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3152 3.3338 -0.8123 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2162 1.9413 -1.2517 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2749 1.6478 -2.4881 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5280 -0.1051 0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9772 0.7538 1.2034 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0103 0.2366 -1.3049 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7559 -0.3473 1.2218 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5325 -1.2299 -1.9731 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5002 -2.2911 -0.4985 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4399 -0.8047 -0.4718 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3283 0.5568 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8589 -3.1095 -0.2473 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3081 -4.1263 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2711 -2.8146 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2565 4.2022 1.1352 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4554 4.2439 -1.3828 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3403 -1.0294 0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7758 1.8459 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1056 0.7282 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6656 0.3438 2.1574 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9038 -0.3684 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2284 -0.0410 -2.0698 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3223 1.2862 -1.3765 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7916 -0.2093 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3961 0.5031 1.3535 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1505 -1.3341 1.5815 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