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
    1.7633    0.5841    0.8678 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9114   -0.2709   -0.3213 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8997   -0.3871   -1.1507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3030    0.2646   -0.9497 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3037   -0.3450   -0.2282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0721   -1.5079    0.2323 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6212    0.2365    0.0557 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4101   -1.1002   -0.5977 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.7036    0.9303    1.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0295    0.0731    1.8174 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4527    1.4518    0.7636 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0274   -1.0150   -2.0116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7632    0.2019    1.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4115   -0.3912   -0.3731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7228    1.2749   -0.2803 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