Monomers

Methyl 2-phenylacrylate

Identifiers

IUPAC name
methyl 2-phenylprop-2-enoate
InchI
InChI=1S/C10H10O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InchI Key
GQTXKEVAUZYHGE-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)c1ccccc1
Canonical SMILES
COC(=O)C(=C)C1=CC=CC=C1
Isomeric SMILES
COC(=O)C(=C)C1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H10O2
Heavy Atom Count
12
Molecular Weight
162.188
Exact Molecular Weight
162.0681
Valence Electrons
62
Radical Electrons
0
tPSA
26.3
MolLogP
1.8728
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

 22 22  0  0  0  0  0  0  0  0999 V2000
    2.2517    1.8305    2.3879 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3933    1.1141    1.5159 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7744    0.7248    0.2479 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9691    1.0672   -0.0704 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9466   -0.0108   -0.7010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5127   -0.2831   -1.8905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4180   -0.4313   -0.4457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9183   -0.5097    0.8359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2381   -0.8959    1.0629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0810   -1.2103    0.0207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6030   -1.1390   -1.2655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2772   -0.7494   -1.4682 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1964    2.8953    2.0744 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3167    1.5333    2.2664 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9622    1.6896    3.4484 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9731   -0.8150   -2.6316 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5214    0.0320   -2.1145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3312   -0.2904    1.7183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6184   -0.9531    2.0742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0979   -1.5046    0.2524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2624   -1.3848   -2.0754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9723   -0.7095   -2.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12  7  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  6 16  1  0
  6 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
 12 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers