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
    3.3841    1.3200    0.4696 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0907    0.8037    0.2759 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8454   -0.3903   -0.3629 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9126   -0.9875   -0.7651 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5403   -0.9871   -0.5984 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4888   -2.1502   -1.2234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7042   -0.3676   -0.1548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8579   -1.1362   -0.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0481   -0.5881    0.3808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1109    0.7571    0.6440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0105    1.5701    0.5232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8242    0.9778    0.1222 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3422    2.4131    0.2779 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1595    0.8324   -0.1312 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6077    1.2183    1.5631 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4591   -2.5867   -1.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4174   -2.6939   -1.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8392   -2.2128   -0.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9289   -1.2380    0.4776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0704    1.1554    0.9533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0586    2.6502    0.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0396    1.6404    0.0220 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