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
-2.6968 -0.4469 -0.1923 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5074 0.4517 0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3460 -0.2656 -0.1904 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8830 0.3255 0.0177 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8906 1.4821 0.4998 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0981 -0.3998 -0.3228 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2817 0.1313 -0.1384 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9945 -2.0101 -0.9911 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.1649 -0.1692 -1.1535 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4429 -0.3896 0.6347 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3647 -1.5146 -0.3218 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6108 1.3423 -0.5332 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5315 0.7591 1.2195 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3573 1.1209 0.2719 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1598 -0.4171 -0.3946 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