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
-2.1973 0.4812 0.2037 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6143 -0.5566 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2777 -0.3348 -1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6625 -0.3060 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2697 -0.4814 1.1583 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0715 -0.0832 -0.2562 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9199 -0.0646 0.7434 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6375 0.1621 -1.8860 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.8808 0.0068 0.9626 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8516 1.1513 -0.3903 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4361 1.0593 0.7341 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7194 -1.5439 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2052 -0.6690 -1.6598 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9915 0.1016 0.5989 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6298 -0.2108 1.7813 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