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
2.2278 0.2462 0.0653 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3490 -0.9739 0.1625 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0197 -0.6111 0.3811 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6518 0.1729 -0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0394 0.5676 -1.6049 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0405 0.5473 -0.3518 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6380 0.1165 0.7422 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8677 1.5436 -1.5367 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.5964 0.4231 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7103 1.1722 0.3633 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1185 0.0780 0.7018 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6237 -1.6342 1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4462 -1.5440 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1496 -0.4933 1.4785 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6651 0.3890 0.9059 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