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
-2.2919 0.3346 -0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5466 -0.9814 -0.2994 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2118 -0.8623 -0.6997 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7160 -0.0841 -0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3279 0.5490 0.9669 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1093 0.0253 -0.4832 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9454 0.7893 0.1908 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6991 -0.8372 -1.8876 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.3282 0.0962 0.0704 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8806 1.0629 0.4008 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4223 0.7121 -1.3272 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0882 -1.6487 -1.0014 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6519 -1.4013 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9805 0.8963 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6432 1.3494 1.0688 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