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
-2.0948 0.4474 -2.3535 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3255 0.0419 -1.1637 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6746 -0.2863 -0.6944 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5482 -0.6631 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1670 -0.6145 0.9883 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7075 -0.9068 2.1119 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3927 -0.1604 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0106 0.0526 -0.2055 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8258 -1.1841 0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2782 -0.9013 0.0637 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6716 0.4906 -0.2958 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8370 1.5735 0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5009 1.0886 0.8148 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5935 -0.2302 -1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3687 -0.9729 1.1912 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2959 0.4081 -1.2134 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5695 -2.0134 -0.6463 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4755 -1.5673 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7042 -1.2175 1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7844 -1.5851 -0.6751 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7211 0.6287 0.1028 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7687 0.6180 -1.3953 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6063 2.3310 -0.4997 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3625 2.1458 1.0945 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1980 1.9303 0.8867 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6583 0.5465 1.7706 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