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
-2.2551 -0.2808 0.1451 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2942 0.8530 0.3612 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0479 0.6420 -0.2432 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8022 -0.3952 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4558 -1.2426 0.8933 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0958 -0.5686 -0.6324 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4326 0.3364 -1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1437 -1.9185 -0.2407 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.2201 0.1697 -0.1968 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4743 -0.8463 1.0743 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9031 -1.0013 -0.6186 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6895 1.8261 -0.0287 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2114 1.0046 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7929 1.1654 -1.7767 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3723 0.2560 -2.0499 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