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
    4.0555    0.4213   -0.5242 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3522    0.9015   -1.5292 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9003    0.8389   -1.4528 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1684    1.2786   -2.3763 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2545    0.2932   -0.3617 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1395    0.2013   -0.2233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6921    0.9132    0.9618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4641    0.0183    1.9045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5549   -0.6603    1.1457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1353   -1.1823   -0.1982 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6291   -1.2425   -0.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1446    0.4317   -0.5070 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5863   -0.0138    0.3474 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8237    1.3347   -2.3967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5705    0.6537   -1.1617 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0932    1.5025    1.5172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4323    1.7053    0.6373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8269   -0.6479    2.4990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9613    0.7123    2.6413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3639    0.1050    0.9697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0528   -1.4673    1.7278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4354   -0.4548   -1.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6068   -2.1576   -0.4389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2450   -1.7555   -1.1411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2688   -1.7297    0.6689 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