Monomers

2-Chloroethyl acrylate

Identifiers

IUPAC name
2-chloroethyl prop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-2-5(7)8-4-3-6/h2H,1,3-4H2
InchI Key
WHBAYNMEIXUTJV-UHFFFAOYSA-N
SMILES
ClCCOC(=O)C=C
Canonical SMILES
C=CC(=O)OCCCl
Isomeric SMILES
C=CC(=O)OCCCl
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
0.9544
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

 15 14  0  0  0  0  0  0  0  0999 V2000
   -1.9877    2.0586   -0.4526 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.2570    0.3158   -0.1931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3973   -0.1882    0.9584 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0349   -0.0151    0.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6922   -0.5694   -0.2948 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560   -1.2814   -1.1064 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1391   -0.3331   -0.4423 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7919    0.4206    0.4238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0211   -0.2302   -1.1261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3283    0.2042    0.0645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6738    0.2869    1.9132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6866   -1.2743    1.0769 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6201   -0.8068   -1.2874 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8507    0.5568    0.2629 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2368    0.8556    1.2381 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  3
  2  9  1  0
  2 10  1  0
  3 11  1  0
  3 12  1  0
  7 13  1  0
  8 14  1  0
  8 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers