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
   -2.2885    0.0177   -0.2427 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4715   -1.0179    0.5032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2013   -0.4984    0.8372 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7113   -0.0542   -0.0997 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4284   -0.1019   -1.3047 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9722    0.4533    0.3681 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8616    0.8834   -0.4983 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3211    0.4993    2.0657 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.4245   -0.3423   -1.2835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7965    1.0082   -0.1827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3121    0.1283    0.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3334   -1.9443   -0.0557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9989   -1.1879    1.4801 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6945    0.8769   -1.5694 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8377    1.2798   -0.1943 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