Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
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
1.302
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
-2.2169 -0.0970 -0.5824 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4735 0.8217 0.3422 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0669 0.7051 0.1758 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5957 -0.5140 0.3875 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1408 -1.4746 0.7293 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0325 -0.6541 0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8284 0.3274 -0.1325 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7571 -2.2149 0.5109 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.0313 -0.5707 -0.0188 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5342 -0.8670 -1.0455 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6086 0.4772 -1.4647 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7177 1.8796 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7678 0.6395 1.3984 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8897 0.2002 -0.2484 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4543 1.3416 -0.3331 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 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers