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
   -2.9443    0.4380   -0.4129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5412   -0.1249   -0.2419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5587    0.7263   -0.2101 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7764    0.5843   -0.0752 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6197   -0.4394    0.0761 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1594   -1.5987    0.1150 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1121   -0.3090    0.2065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4738   -1.8504   -0.1137 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.9554    1.5142   -0.1816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1907    0.2296   -1.4807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6347   -0.1298    0.2146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8357    1.8288   -0.3139 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4341   -0.2009    1.2436 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4420    0.5427   -0.4398 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5909   -1.2108   -0.2310 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