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
1.1370 0.6836 2.3991 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6856 0.4438 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1104 0.6709 0.9832 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3792 0.3313 -0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1282 -0.1512 -0.8897 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0495 -0.5525 -2.0854 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1113 -0.0649 0.0903 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2462 -0.4386 -0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5915 -1.7961 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8912 -2.2040 -0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8988 -1.2635 -0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6044 0.0613 -0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2843 0.4600 -0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9984 1.9331 -0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7985 1.0682 1.7175 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3179 0.3716 -0.8034 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2047 -2.5127 -0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1622 -3.2683 -0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9161 -1.6122 -0.4853 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3525 0.8248 -0.3132 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3525 2.2221 0.7689 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9700 2.4786 0.1193 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6541 2.3146 -1.0562 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