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
-2.2710 0.1817 0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3505 -0.9266 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0052 -0.6363 -0.1305 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6361 0.3762 -0.8349 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1031 1.0555 -1.5643 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0611 0.6336 -0.7345 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8624 -0.0781 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7573 1.9367 -1.6666 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.2051 0.4001 1.3183 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1895 1.0894 -0.3915 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3039 -0.2016 0.0651 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5440 -1.7705 0.5102 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6725 -1.2882 -1.1908 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3954 -0.8913 0.6102 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9220 0.1193 0.1053 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