Monomers
MALEIMIDE, N-o-TOLYL-
Identifiers
IUPAC name
1-(2-methylphenyl)pyrrole-2,5-dione
InchI
InChI=1S/C11H9NO2/c1-8-4-2-3-5-9(8)12-10(13)6-7-11(12)14/h2-7H,1H3
InchI Key
QYOJZFBQEAZNEW-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1c1ccccc1C
Canonical SMILES
CC1=CC=CC=C1N2C(=O)C=CC2=O
Isomeric SMILES
CC1=CC=CC=C1N2C(=O)C=CC2=O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C11H9NO2
Heavy Atom Count
14
Molecular Weight
187.198
Exact Molecular Weight
187.0633
Valence Electrons
70
Radical Electrons
0
tPSA
37.38
MolLogP
1.4244
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
23 24 0 0 0 0 0 0 0 0999 V2000
1.3021 -0.3558 -2.5144 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7796 -0.0599 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1681 0.3713 -1.1457 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2801 0.5934 0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9882 0.3288 0.8098 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8106 0.4634 2.0584 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0576 -0.0802 -0.1780 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3015 -0.4423 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6715 -1.7909 -0.0939 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9504 -2.1957 0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9372 -1.2523 0.3644 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5609 0.0727 0.4662 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2594 0.5032 0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8832 1.9338 0.3862 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9094 0.4612 -1.9367 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1715 0.9215 0.6293 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1491 -2.4897 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2566 -3.2180 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9378 -1.6060 0.4851 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3036 0.8126 0.6868 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0742 2.1396 0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9188 2.4447 -0.6164 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7096 2.4450 0.9646 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
5 7 1 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
13 14 1 0
7 2 1 0
13 8 1 0
3 15 1 0
4 16 1 0
9 17 1 0
10 18 1 0
11 19 1 0
12 20 1 0
14 21 1 0
14 22 1 0
14 23 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers