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
    1.9422   -0.6422    0.2064 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7828    0.6576   -0.5271 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5896    0.9707   -0.9636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5157    0.1191   -0.7552 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3171    0.2234    0.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0485    1.0986    1.2197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4893   -0.6634    0.6123 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1325    1.7122   -0.7895 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.9679   -0.7433    0.6222 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6932   -1.4494   -0.5010 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2353   -0.5876    1.0608 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4755    1.9062   -1.4914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5969   -1.4136   -0.2041 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4386   -1.1431    1.5948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4129   -0.0451    0.5881 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