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
-2.1007 1.5994 -2.0205 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3247 0.8778 -1.0171 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6655 0.6167 -0.5111 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5737 -0.1701 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1744 -0.4685 0.7906 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7177 -1.1892 1.7157 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3985 0.1939 -0.1953 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0195 0.2039 -0.3697 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7384 0.8162 0.8412 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1819 0.4084 0.8597 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7241 0.0681 -0.5019 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9545 -0.9941 -1.2063 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6026 -1.1968 -0.5067 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5969 0.9939 -0.9165 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4445 -0.5174 1.1145 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3419 0.8163 -1.2363 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2100 0.4492 1.7329 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5911 1.9124 0.7921 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3995 -0.4204 1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7744 1.2874 1.2297 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7682 -0.2690 -0.3714 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7719 1.0294 -1.0786 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4820 -1.9334 -1.3696 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6804 -0.5926 -2.2255 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0142 -1.8443 -1.1563 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7421 -1.6773 0.4800 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