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
2.6851 0.4059 0.2118 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5072 -0.5166 -0.0652 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3567 0.2720 -0.1006 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8681 -0.3276 -0.3386 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8843 -1.5667 -0.5130 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0570 0.4803 -0.3761 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2438 -0.0550 -0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9886 2.2058 -0.1274 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.4311 0.9273 1.1766 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6673 1.2109 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6393 -0.1284 0.2683 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7291 -0.9858 -1.0621 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4973 -1.3046 0.7091 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1524 0.5048 -0.6371 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3189 -1.1223 -0.7584 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