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
    5.2910   -0.3903    0.4682 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9911   -0.6010    0.4722 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1282    0.4484    0.2268 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7015    0.2293    0.2287 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4514   -0.9738    0.4717 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8175    1.2953   -0.0206 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4408    1.4622   -0.0680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5625    0.5853    0.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5669   -0.6226    0.7955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6887   -1.4655    0.8629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8379   -1.0511    0.2326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8710    0.1428   -0.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7735    0.9659   -0.4989 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0202   -1.1653    0.6522 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6668    0.5966    0.2739 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6675   -1.6227    0.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3930    2.2807   -0.2420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7868    2.5511   -0.2968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6876   -0.9223    1.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6225   -2.3973    1.3960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7089   -1.7042    0.2842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7887    0.4519   -0.9225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7924    1.9066   -1.0251 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