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
-2.3696 -0.4262 -0.8551 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4308 0.6130 -0.3269 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1193 0.0929 -0.2343 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9643 0.8035 0.2154 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8261 1.9797 0.5727 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2564 0.1090 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3776 -1.1343 -0.1356 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6840 0.9758 0.8168 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.7801 -1.2200 -1.3774 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9670 -0.9307 -0.0922 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0777 -0.0078 -1.6238 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3944 1.4391 -1.0684 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8121 1.0111 0.6249 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3315 -1.6041 -0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5109 -1.7010 -0.4948 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