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
   -2.1971    0.9421    0.2842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9235   -0.5078    0.4808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7080   -0.9897    0.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3353   -0.1610    0.0762 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6491   -0.5606   -0.0601 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9183   -1.7631    0.0964 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6929    0.4502   -0.3870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2865   -1.5345    0.8594 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1705    1.2364    0.7146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4061    1.5430    0.8184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1022    1.1739   -0.7916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5547   -2.0385    0.5222 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7242    0.5702   -1.4733 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3573    1.4184    0.0444 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6716    0.2210    0.0359 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