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
-2.1699 -0.3667 0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4269 0.9428 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0464 0.6497 0.3221 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5557 -0.1520 -0.6298 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1699 -0.6152 -1.5436 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9827 -0.4697 -0.6045 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7773 0.0007 0.3431 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7209 -1.4851 -1.8185 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.6474 -0.3806 1.3963 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4504 -1.1989 0.3158 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9792 -0.4476 -0.3825 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6655 1.6291 1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6270 1.4710 -0.6832 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8332 -0.2176 0.3861 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3129 0.6400 1.1075 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