Monomers

2-Chloroprop-1-enyl acetate

Identifiers

IUPAC name
2-chloroprop-1-enyl acetate
InchI
InChI=1S/C5H7ClO2/c1-4(6)3-8-5(2)7/h3H,1-2H3
InchI Key
OPZZKYKMMQTPEL-UHFFFAOYSA-N
SMILES
CC(=COC(=O)C)Cl
Canonical SMILES
CC(=COC(=O)C)Cl
Isomeric SMILES
CC(=COC(=O)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
1.6496
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
   -2.9597    0.2189    0.1172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5252    0.0654   -0.3481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5898    0.1262    0.5455 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7492    0.0404    0.5388 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6435   -0.1477   -0.4398 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2477   -0.2808   -1.6189 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1420   -0.2067   -0.1717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3337   -0.1739   -2.0385 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3643   -0.8169    0.1359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9917    0.7136    1.1017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5197    0.8656   -0.5940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9596    0.2955    1.6314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5561    0.8197   -0.1065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3243   -0.6960    0.8148 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5810   -0.8234   -0.9562 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  2  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  3 12  1  0
  7 13  1  0
  7 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers