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
-3.4977 0.0053 0.4851 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.0404 -0.5045 -0.4362 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8542 0.2005 0.1694 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3419 -0.1252 -0.4747 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5198 0.4470 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6937 -0.1044 -0.2868 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9618 -1.5868 -0.3155 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1717 -0.2618 -1.5108 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8383 -0.0725 1.2535 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0247 1.3072 0.1376 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4979 1.3710 0.5505 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6117 0.3444 0.0632 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7237 -1.0201 -0.8594 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