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
-2.2074 0.2655 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6360 -0.8525 0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2455 -0.9958 -0.0195 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6792 -0.0166 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2216 1.0681 0.7388 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1141 -0.1867 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9343 0.7944 0.4754 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8373 -1.6619 -0.4540 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.5704 0.5563 -1.5655 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4126 1.1678 -0.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2196 -0.0670 -1.0459 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0825 -1.8479 -0.1559 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9501 -0.6866 1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5338 1.7248 0.8531 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0039 0.7381 0.3912 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