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
-1.9747 1.5257 0.0838 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8440 1.0407 -0.8221 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0999 0.1069 -0.0655 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0074 -0.5290 -0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3258 -0.2494 -1.7702 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7664 -1.4994 0.2125 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3832 -1.7571 1.4488 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1526 -2.2665 -0.5191 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.7335 2.0967 -0.4833 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5441 2.1171 0.9238 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4078 0.6098 0.5536 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2772 0.6129 -1.7355 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2463 1.9308 -1.1003 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9626 -2.4722 2.0115 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5295 -1.2672 1.8608 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