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
   -3.7619   -0.4738   -1.9248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5951   -0.9840   -1.3107 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5393   -0.1596   -0.9187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6975    1.0581   -1.1481 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3556   -0.7460   -0.2870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3367   -2.0677   -0.1033 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7939    0.0085    0.1739 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7314   -0.4908    1.0568 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8359    0.2046    1.4893 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0419    1.4709    1.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1371    2.0247    0.1462 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0232    1.2906   -0.2749 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4831   -0.2357   -1.1194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5599    0.4545   -2.5021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2417   -1.2203   -2.5850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1870   -2.6903   -0.4184 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4729   -2.6018    0.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6207   -1.4875    1.4604 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5243   -0.2551    2.1814 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8975    2.0449    1.3506 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2853    3.0383   -0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3939    1.8177   -0.9669 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