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
   -2.9338   -0.0213   -0.1765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4953   -0.0760   -0.5183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6416    0.6989    0.0979 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7236    0.7039   -0.1686 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6178   -0.1071    0.4901 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1511   -0.8794    1.3698 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0740   -0.1075    0.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0090   -1.2144   -1.7701 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.4878   -0.9164   -0.5535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3559    0.8714   -0.6802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0512   -0.0025    0.9218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9813    1.3801    0.8567 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2816   -0.5755   -0.7528 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5053    0.9137    0.2171 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6023   -0.6678    1.0111 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