Monomers
N-Cyclohexylmaleimide
Identifiers
IUPAC name
1-cyclohexylpyrrole-2,5-dione
InchI
InChI=1S/C10H13NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h6-8H,1-5H2
InchI Key
BQTPKSBXMONSJI-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1C1CCCCC1
Canonical SMILES
C1CCC(CC1)N2C(=O)C=CC2=O
Isomeric SMILES
C1CCC(CC1)N2C(=O)C=CC2=O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H13NO2
Heavy Atom Count
13
Molecular Weight
179.219
Exact Molecular Weight
179.0946
Valence Electrons
70
Radical Electrons
0
tPSA
37.38
MolLogP
1.2441
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
2
Aromatic Rings
0
MOL File
RDKit 3D
26 27 0 0 0 0 0 0 0 0999 V2000
2.6232 2.2621 -0.0152 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6041 0.9912 -0.0309 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7602 0.1354 -0.0734 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3398 -1.1294 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8662 -1.1540 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1366 -2.1871 -0.0312 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4260 0.1951 -0.0088 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0343 0.6126 0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6898 0.2502 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1305 0.7369 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7626 -0.2040 -0.0629 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8863 -0.6494 1.0527 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6569 0.1542 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7813 0.5089 -0.0966 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9661 -1.9975 -0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0554 1.7425 0.0484 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6949 -0.8400 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2347 0.7956 -2.0781 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0789 1.7800 -0.6397 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7038 0.7225 -1.9736 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0639 -1.1224 -0.6483 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7490 0.2097 0.2986 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4978 -0.5794 2.0014 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6409 -1.7498 0.9841 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8738 1.0065 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0706 -0.4903 1.8389 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 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 13 1 0
7 2 1 0
13 8 1 0
3 14 1 0
4 15 1 0
8 16 1 0
9 17 1 0
9 18 1 0
10 19 1 0
10 20 1 0
11 21 1 0
11 22 1 0
12 23 1 0
12 24 1 0
13 25 1 0
13 26 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers