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
   -3.2426   -0.7948    1.5011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9867   -0.4815    0.9237 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7290    0.7078    0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7352    1.5101    0.2548 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4829    1.1123   -0.3365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3911    2.2907   -0.9297 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6930    0.2608   -0.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6533    0.4021   -1.3796 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7597   -0.3961   -1.3604 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9640   -1.3311   -0.3830 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0219   -1.4647    0.6068 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8780   -0.6754    0.6321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3543   -0.3450    2.4986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3383   -1.9114    1.5161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0285   -0.4487    0.7797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2925    2.9302   -0.9276 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4908    2.6696   -1.4031 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4787    1.1453   -2.1592 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4815   -0.2439   -2.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8563   -1.9375   -0.4139 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1497   -2.2002    1.4042 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1542   -0.7987    1.4383 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