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
    4.6394    0.4966    0.3921 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4716    0.3960   -0.2112 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    0.2660    0.5137 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2612    0.2505    1.7656 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0307    0.1646   -0.1466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2377    0.0346    0.5024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1338    1.1740    0.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2529    0.9416   -0.7202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8243   -0.4396   -0.7012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6713   -1.3753   -1.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7682   -1.3286    0.1912 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7214    0.4872    1.4739 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5492    0.5913   -0.1634 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4853    0.4147   -1.3098 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0073    0.0405    1.5884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5967    1.5959    1.1745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5097    2.0261   -0.1561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1138    1.6442   -0.5218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9420    1.1605   -1.7674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6308   -0.4897   -1.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1841   -0.7278    0.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1823   -1.1161   -1.9513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0468   -2.4136   -1.0976 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0634   -2.0416    0.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3505   -1.7522    1.0385 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