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
-2.2303 0.3003 0.4632 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5365 -1.0159 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1977 -1.0210 0.6536 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6875 -0.0983 0.1188 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2456 0.7097 -0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0824 -0.0183 0.5106 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8813 0.8772 -0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6535 -1.1449 1.7125 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.3307 0.1086 0.4907 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0353 1.0422 -0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9571 0.7256 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1383 -1.8074 0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5836 -1.1999 -0.9095 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9258 0.9631 0.2415 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5332 1.5789 -0.7746 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