Monomers

Methyl acrylate

Identifiers

IUPAC name
methyl prop-2-enoate
InchI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InchI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
SMILES
COC(=O)C=C
Canonical SMILES
COC(=O)C=C
Isomeric SMILES
COC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.3454
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
   -2.0810   -0.1484    0.4752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6706    0.0123    0.4387 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0752   -0.1352   -0.7254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5707   -0.4230   -1.7632 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5110    0.0256   -0.7761 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1887    0.3260    0.3051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3469   -1.1645    0.7998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5656    0.1578   -0.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4865    0.5407    1.2704 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0280   -0.1007   -1.7014 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6797    0.4601    1.2643 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2387    0.4494    0.2965 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
  1  7  1  0
  1  8  1  0
  1  9  1  0
  5 10  1  0
  6 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers