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
cid=

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
   -0.1553    1.5457   -2.4382 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0517    1.1788   -1.0379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7590    0.3585   -0.4407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6195   -0.0350    0.8967 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1320   -1.1491    1.1807 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6707   -1.7778    0.2171 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3424   -1.6496    2.5584 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4004    1.8579   -0.1849 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1725    1.2768   -2.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5668    1.0786   -3.1388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0467    2.6652   -2.5166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5999   -0.0450   -1.0264 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0679   -2.4669    2.5714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6346   -1.9889    2.9529 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7556   -0.8492    3.2243 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