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
   -3.5308    0.7154    0.4809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1492    0.4174    0.3147 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4080   -0.1749    1.3068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0501   -0.4361    2.3838 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0047   -0.5048    1.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6557   -1.0679    2.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7658   -0.2061   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1423   -0.0194    0.0829 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8904    0.2387   -1.0426 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3277    0.3261   -2.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9646    0.1421   -2.3863 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1821   -0.1216   -1.2588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0386    0.7703   -0.5095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6102    1.7387    0.9208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0334    0.0036    1.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6877   -1.3359    2.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0903   -1.2682    3.1087 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6290   -0.0702    1.0488 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9731    0.3882   -0.9993 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9159    0.5292   -3.1828 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4682    0.2015   -3.3600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8775   -0.2662   -1.3917 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