Monomers

Ethyl 2-chloroacrylate

Identifiers

IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
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
1.302
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
   -2.2811   -0.1855   -0.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5396   -0.5369    1.2208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2931    0.0856    1.3358 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7545   -0.0595    0.4462 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5578   -0.8115   -0.5364 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9982    0.6522    0.6945 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9869    0.5068   -0.1574 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2230    1.6901    2.0811 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.6795    0.8314    0.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1783   -0.8670   -0.0748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7084   -0.4136   -0.9556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5128   -1.6340    1.3586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1642   -0.1500    2.0747 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9173    1.0147   -0.0077 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9195   -0.1227   -1.0426 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  2  0
  4  6  1  0
  6  7  2  3
  6  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  7 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers