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
   -2.9053    0.2392    0.3076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5698   -0.0890   -0.2242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6064   -0.4809    0.5590 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6713   -0.8054    0.1291 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6546    0.1559    0.0612 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3202    1.3317    0.4105 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0449   -0.1225   -0.3904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2906    0.0555   -1.9370 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1692   -0.5780    1.0336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9440    1.1934    0.8598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6966    0.2577   -0.4606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7854   -0.5686    1.6203 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6248    0.8210   -0.3461 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0946   -0.5771   -1.3856 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5568   -0.8328    0.3119 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