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
-2.7369 0.1315 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5053 -0.4618 -0.1309 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3496 0.2332 0.3469 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8874 -0.1683 -0.0957 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9639 -1.1220 -0.8967 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0993 0.4897 0.3465 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3049 0.1364 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9508 1.8243 1.4711 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.5486 0.7698 1.3567 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4752 -0.6457 0.7801 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2165 0.7963 -0.2841 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4178 -1.5572 0.0706 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5463 -0.3874 -1.2541 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1655 0.6418 0.2925 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4244 -0.6806 -0.7442 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