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
   -2.9493    0.0709    0.0497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5253    0.4890    0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6627   -0.1188   -0.7366 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6760    0.2136   -0.8042 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6413   -0.3502    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2577   -1.2145    0.8388 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0773   -0.0194   -0.0437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0885    1.8195    1.0953 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1236   -0.3744    1.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1407   -0.7260   -0.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6333    0.9399   -0.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9939   -0.9311   -1.3666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3647    0.5321   -0.9630 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4056    0.6240    0.8065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6948   -0.9545   -0.0313 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