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
   -2.9246   -0.0476   -0.0619 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5025   -0.2006   -0.3907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6277   -0.6492    0.4897 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7119   -0.7895    0.1683 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6025    0.2735    0.3760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1997    1.3558    0.8518 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0478    0.1674    0.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9618    0.2272   -1.9998 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1460   -0.0637    1.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5214   -0.7899   -0.6298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2521    0.9532   -0.4453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9214   -0.9240    1.4932 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4129   -0.8823    0.0823 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6209    0.7980    0.7660 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2616    0.5717   -0.9656 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