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
1.1771 -0.2649 2.0356 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8792 -0.2185 0.9924 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3299 -0.3583 0.9479 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7396 -0.2593 -0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5496 -0.0456 -1.1566 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5131 0.0968 -2.3993 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3869 -0.0209 -0.3387 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0090 0.1577 -0.6912 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7278 -1.1145 -0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2176 -1.0159 -0.4482 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7793 0.2755 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7498 1.0257 0.8938 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5641 1.3626 0.0464 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9345 -0.5167 1.8266 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7576 -0.3180 -0.6896 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1050 0.2897 -1.7886 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4386 -1.4659 0.6981 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3837 -1.8980 -1.0255 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5663 -1.1912 -1.5012 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6695 -1.8554 0.1422 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6522 0.1029 0.7657 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1206 0.9281 -0.7448 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4768 0.3931 1.7398 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2074 1.9681 1.2369 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2235 1.8046 0.7018 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8233 2.1381 -0.7007 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