Monomers

Ethenyl 3-phenyl-2-propenoate

Identifiers

IUPAC name
ethenyl 3-phenylprop-2-enoate
InchI
InChI=1S/C11H10O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h2-9H,1H2
InchI Key
WGXGKXTZIQFQFO-UHFFFAOYSA-N
SMILES
C=COC(=O)C=Cc1ccccc1
Canonical SMILES
C=COC(=O)C=CC1=CC=CC=C1
Isomeric SMILES
C=COC(=O)C=CC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H10O2
Heavy Atom Count
13
Molecular Weight
174.199
Exact Molecular Weight
174.0681
Valence Electrons
66
Radical Electrons
0
tPSA
26.3
MolLogP
2.3865
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 23 23  0  0  0  0  0  0  0  0999 V2000
    5.1843   -1.6901   -1.3062 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9549   -2.0047   -0.9971 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0409   -0.9708   -0.8005 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7334   -1.2602   -0.4728 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4209   -2.4735   -0.3644 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7259   -0.2182   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4963   -0.5523    0.0545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5691    0.4083    0.2919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8493   -0.0155    0.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8772    0.8587    0.8450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6798    2.2077    0.7613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4303    2.6759    0.4431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3929    1.7766    0.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4680   -0.6672   -1.4025 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9121   -2.4587   -1.4643 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6672   -3.0464   -0.8993 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0020    0.8247   -0.3485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7577   -1.6016    0.1460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0104   -1.0863    0.6840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8442    0.4672    1.0920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4846    2.9010    0.9401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2734    3.7366    0.3768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4442    2.1887   -0.0303 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13  8  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
  6 17  1  0
  7 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
 12 22  1  0
 13 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers