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
2.1577 0.7723 -1.5308 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1501 0.0629 -0.4878 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2687 -0.6992 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8743 -1.3064 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4728 -0.9830 1.4095 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7630 -1.3823 2.3775 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0269 -0.1174 0.3829 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2440 0.4875 0.1831 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5902 1.7327 0.6659 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8444 2.2813 0.4441 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8046 1.6000 -0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4657 0.3546 -0.7597 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2053 -0.1936 -0.5351 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8679 -1.5350 -1.0691 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2497 -0.7707 -0.4013 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4536 -1.9622 1.7731 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1699 2.2715 1.2343 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1157 3.2567 0.8222 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7887 2.0241 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2042 -0.2037 -1.3291 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0498 -1.5095 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6539 -2.2139 -0.2109 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7523 -1.9667 -1.5818 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