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
-2.6586 0.6591 0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5904 -0.4314 0.1386 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3463 0.2150 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8500 -0.4660 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8914 -1.6959 0.2472 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0825 0.3304 -0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2632 -0.2573 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0149 2.0556 -0.2879 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.6274 1.2753 0.9338 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3435 1.2605 -0.8831 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6247 0.1696 -0.1525 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7055 -1.0343 1.0386 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6945 -1.1043 -0.7414 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3492 -1.3304 0.1361 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1398 0.3542 -0.1114 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