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
-1.7502 -1.4905 0.8979 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8335 -0.4606 0.1874 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1598 -0.0347 -0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3192 1.0328 -1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3587 -0.8115 0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6823 0.2305 -0.1452 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5587 -0.2411 0.3236 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4003 -0.6200 -0.8389 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8601 -0.6405 -0.6303 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3537 0.0523 0.5925 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5018 1.2738 0.8277 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1333 0.7961 1.2302 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4874 1.6394 -1.3191 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3009 1.3236 -1.3207 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1881 -0.7041 -0.6124 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1026 -1.8813 0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7529 -0.4308 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3666 -1.1515 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0827 -1.6512 -1.1765 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1581 0.0406 -1.6978 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2596 -1.6969 -0.5896 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4068 -0.1877 -1.5096 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2939 -0.6218 1.4674 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4063 0.3502 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5047 1.9295 -0.0553 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9497 1.8108 1.6964 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2131 0.4307 2.2758 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4864 1.7138 1.2934 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