Monomers
Cyclohexyl methacrylate
Identifiers
IUPAC name
cyclohexyl 2-methylprop-2-enoate
InchI
InChI=1S/C10H16O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h9H,1,3-7H2,2H3
InchI Key
OIWOHHBRDFKZNC-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)OC1CCCCC1
Canonical SMILES
CC(=C)C(=O)OC1CCCCC1
Isomeric SMILES
CC(=C)C(=O)OC1CCCCC1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H16O2
Heavy Atom Count
12
Molecular Weight
168.236
Exact Molecular Weight
168.115
Valence Electrons
68
Radical Electrons
0
tPSA
26.3
MolLogP
2.4384
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
28 28 0 0 0 0 0 0 0 0999 V2000
-1.5995 -0.8372 1.4968 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8595 -0.2384 0.4139 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2159 -0.0056 -0.0457 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4051 0.6284 -1.1898 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4156 -0.4411 0.6992 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7853 0.1893 -0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5573 0.0236 0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3401 -0.7810 -1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5567 -1.2973 -0.2352 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3844 -0.1286 0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6765 1.0206 0.7408 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3113 1.2996 0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4013 0.8352 -1.5915 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5731 0.9691 -1.7757 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1965 0.3213 0.5602 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2096 -0.4803 1.8032 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7644 -1.4506 0.3952 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5779 -0.5244 1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7674 -1.5710 -1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7757 -0.0898 -1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1503 -1.7851 0.6785 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1420 -1.9703 -0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9817 0.1864 -0.7259 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1466 -0.4923 0.9029 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2959 1.9468 0.5522 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6358 0.8877 1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3688 1.8909 -0.7226 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7574 1.8942 0.9964 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
3 5 1 0
2 6 1 0
6 7 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 7 1 0
4 13 1 0
4 14 1 0
5 15 1 0
5 16 1 0
5 17 1 0
7 18 1 0
8 19 1 0
8 20 1 0
9 21 1 0
9 22 1 0
10 23 1 0
10 24 1 0
11 25 1 0
11 26 1 0
12 27 1 0
12 28 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers