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
-1.7375 -0.9767 1.8652 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2131 -0.3984 0.8537 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6090 -0.1512 0.5107 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6758 0.4902 -0.6457 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3138 0.7062 -1.1386 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9737 1.2818 -2.2063 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4234 0.1434 -0.1862 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0001 0.1413 -0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6542 0.8492 0.9051 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0780 1.1612 0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7748 -0.1542 0.2616 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0613 -1.1134 -0.6336 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5905 -1.2524 -0.3181 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4724 -0.4425 1.1029 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5845 0.8116 -1.1596 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3304 0.6424 -1.2211 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1112 1.7444 1.2036 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7605 0.0903 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9653 1.7221 -0.5182 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 1.7517 1.1764 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7664 0.0650 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9161 -0.5860 1.2784 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5834 -2.0912 -0.5657 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1936 -0.7597 -1.6919 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1420 -1.8715 -1.1241 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4554 -1.8037 0.6205 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