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
-2.2742 0.3703 0.1553 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5991 -0.8832 -0.3611 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2416 -0.6229 -0.7436 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6829 -0.1497 0.1722 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2704 0.0370 1.3447 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0714 0.1331 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9202 0.5798 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6296 -0.1305 -1.7841 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.0675 0.7106 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4811 1.1367 0.2565 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6742 0.2164 1.1881 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6290 -1.6410 0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1767 -1.2948 -1.1994 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9372 0.7766 0.4568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6318 0.7616 1.7598 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