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
2.2322 -0.3023 -0.5597 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3494 0.8590 -0.2302 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0005 0.5704 -0.1425 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5899 -0.3132 0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1238 -0.9357 1.5163 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0541 -0.5028 0.6806 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7852 0.1725 -0.1763 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8389 -1.6306 1.7756 Cl 0 0 0 0 0 0 0 0 0 0 0 0
3.2073 0.1435 -0.9167 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4745 -0.9055 0.3517 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8173 -0.9762 -1.3386 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4883 1.6578 -1.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7142 1.2869 0.7363 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8465 0.0188 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2918 0.8575 -0.8387 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