Monomers
2-Chloroethyl vinyl ether
Identifiers
IUPAC name
1-chloro-2-ethenoxyethane
InchI
InChI=1S/C4H7ClO/c1-2-6-4-3-5/h2H,1,3-4H2
InchI Key
DNJRKFKAFWSXSE-UHFFFAOYSA-N
SMILES
ClCCOC=C
Canonical SMILES
C=COCCCl
Isomeric SMILES
C=COCCCl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H7ClO
Heavy Atom Count
6
Molecular Weight
106.552
Exact Molecular Weight
106.0185
Valence Electrons
36
Radical Electrons
0
tPSA
9.23
MolLogP
1.3853
H Bond Acceptors
1
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
13 12 0 0 0 0 0 0 0 0999 V2000
3.0379 -0.7155 -0.3107 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.8809 -0.0894 0.8859 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5892 0.3393 0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0381 -0.7291 -0.4454 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2379 -0.4494 -1.0918 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2739 -0.0938 -0.3769 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3518 0.8127 1.3291 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7186 -0.7957 1.7162 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0980 0.8419 0.9123 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8632 1.0948 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3466 -0.5151 -2.1662 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2374 0.1380 -0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2096 -0.0159 0.6948 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 2 3
2 7 1 0
2 8 1 0
3 9 1 0
3 10 1 0
5 11 1 0
6 12 1 0
6 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers