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
    4.0115    0.7961    0.4584 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9597   -0.0059    0.0194 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6001    0.3339    0.2073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4071    1.4160    0.8013 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5650   -0.5576   -0.2809 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9142   -1.6627   -0.8968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8407   -0.2477   -0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2959    0.5897    0.8914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6580    0.8554    0.9457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5349    0.3190    0.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0791   -0.5043   -0.9682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7260   -0.7834   -1.0431 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8539    1.8771    0.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1507    0.5841    1.5549 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9177    0.5076   -0.1258 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9604   -1.8785   -1.0247 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2197   -2.3640   -1.2716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6337    1.0147    1.6225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0291    1.5063    1.7352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5975    0.5494    0.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7710   -0.9202   -1.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3939   -1.4250   -1.8425 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