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
2.2518 -0.2693 0.6733 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6790 -0.0354 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3849 0.4942 -0.6774 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7062 -0.1188 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5371 -1.2320 0.4515 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9915 0.5632 -0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0861 0.0404 0.3829 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1082 2.1375 -0.9549 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.9838 0.6007 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3595 -0.3139 0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8546 -1.2206 1.0791 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3173 0.6739 -1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7072 -1.0069 -1.2585 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1048 -0.9070 0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0042 0.5942 0.3079 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