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
1.7927 -1.3489 1.6529 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0398 -0.6293 0.6518 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3491 -0.1522 0.2176 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1751 0.5735 -0.8729 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7629 0.6213 -1.2233 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2531 1.2240 -2.2031 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0379 -0.1268 -0.2798 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3394 -0.4069 -0.1549 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8535 -1.6339 -0.5128 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2087 -1.9201 -0.3778 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0616 -0.9408 0.1313 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5627 0.3020 0.4982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1883 0.5459 0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6582 1.8512 0.7307 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2798 -0.3870 0.7468 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9624 1.0452 -1.4075 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1746 -2.3725 -0.9055 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6042 -2.8910 -0.6632 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1205 -1.1935 0.2259 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2346 1.0602 0.8975 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0932 2.2782 0.0355 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2419 1.9089 1.7532 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4982 2.5926 0.7154 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