Monomers

Cyclohexyl acrylate

Identifiers

IUPAC name
cyclohexyl prop-2-enoate
InchI
InChI=1S/C9H14O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2,8H,1,3-7H2
InchI Key
KBLWLMPSVYBVDK-UHFFFAOYSA-N
SMILES
C=CC(=O)OC1CCCCC1
Canonical SMILES
C=CC(=O)OC1CCCCC1
Isomeric SMILES
C=CC(=O)OC1CCCCC1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H14O2
Heavy Atom Count
11
Molecular Weight
154.209
Exact Molecular Weight
154.0994
Valence Electrons
62
Radical Electrons
0
tPSA
26.3
MolLogP
2.0483
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

 25 25  0  0  0  0  0  0  0  0999 V2000
    4.7102    0.4370    0.6838 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6712    0.3121   -0.1378 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3155    0.2375    0.4143 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1075    0.2889    1.6539 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2402    0.1094   -0.4146 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1148    0.0295    0.0377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6533   -1.2904   -0.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1149   -1.4535   -0.3432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9606   -0.2552   -0.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3001    1.0602   -0.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8733    1.1215   -0.6353 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5488    0.4816    1.7324 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7000    0.4888    0.2318 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8041    0.2639   -1.2126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1010    0.0901    1.1324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2647   -1.4624   -1.4471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1254   -2.0809    0.2087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3658   -2.0220    0.6024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4142   -2.1827   -1.1555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8077   -0.3081    0.3443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4986   -0.2170   -1.3968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3784    1.4097    0.8627 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8470    1.8632   -0.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8115    0.9691   -1.7252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4663    2.1094   -0.3238 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11  6  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  6 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 10 22  1  0
 10 23  1  0
 11 24  1  0
 11 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers