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
3.2890 0.3902 -0.5499 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.5748 0.5711 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9941 -0.6895 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3658 -0.4526 0.7376 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2205 -0.0884 -0.2981 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5016 0.1243 -0.0812 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0162 0.8311 -1.0544 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4671 1.4120 0.5762 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0904 -1.4757 -0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5350 -1.0714 1.3059 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8410 0.0268 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1320 0.4038 -0.9024 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9056 0.0183 0.9061 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