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
    3.1966    1.7179    0.0378 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9591    1.0692    0.0319 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8853   -0.3029    0.1881 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0038   -0.9147    0.3342 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6494   -1.0419    0.1914 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7629   -2.3699    0.3441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6706   -0.4284    0.0154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7198   -1.2179   -0.4683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9913   -0.6955   -0.6302 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2216    0.6273   -0.3076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1947    1.4077    0.1679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9079    0.8846    0.3338 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2054    2.6013    0.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0405    1.0496    0.3101 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4246    2.1275   -0.9705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0947   -3.0123    0.3614 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7166   -2.8591    0.4568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5213   -2.2419   -0.7222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7779   -1.3539   -1.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2309    0.9885   -0.4516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3953    2.4409    0.4147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1181    1.5236    0.7205 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