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
   -2.7565   -0.3037   -0.4451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5288    0.0343    0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3391   -0.1363   -0.3965 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8874    0.1379    0.1906 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8511    0.5394    1.3907 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1551   -0.0088   -0.4808 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2697    0.2734    0.1509 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2857   -0.5577   -2.1367 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2089    0.5896   -0.9260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5024   -1.0881   -1.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5069   -0.7233    0.2566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4743   -0.6376    1.2282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5687    1.0889    0.6694 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1841    0.6161    1.1852 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2525    0.1760   -0.3210 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