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
-2.0841 -0.1659 0.9358 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5024 0.6817 -0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0936 0.7255 -0.1258 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5973 -0.4690 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0742 -1.5140 -0.3648 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0393 -0.5515 -0.1863 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7124 0.5746 -0.0418 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8000 -2.1111 -0.3259 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.2019 -1.2248 0.6044 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4664 -0.1337 1.8481 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1019 0.1940 1.2027 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8632 1.7201 -0.1257 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7859 0.1976 -1.1537 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7878 0.5377 -0.0073 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2366 1.5388 0.0444 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