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
-2.2799 -0.0066 0.1273 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2984 -0.9681 -0.4664 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0489 -0.6575 -0.1424 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6426 0.5495 -0.4927 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0364 1.3821 -1.1119 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0208 0.7853 -0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7249 -0.1163 0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7498 2.3102 -0.5735 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.0668 -0.5198 0.7191 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7504 0.6730 0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7928 0.6034 -0.6581 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4444 -1.1093 -1.5568 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4906 -1.9756 -0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7367 0.0952 0.7894 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2359 -1.0455 0.7947 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