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
2.7406 0.4405 -1.6237 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.0652 0.0604 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5728 0.2518 -0.1009 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0551 -0.0317 1.1481 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4311 0.1009 1.2235 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2808 -0.5556 0.4836 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5209 0.7214 0.7729 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3575 -0.9754 0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1941 -0.4575 -0.8556 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3827 1.3127 -0.3572 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8191 0.7989 1.9482 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3312 -0.4145 0.5835 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9166 -1.2519 -0.2406 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