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
-2.2777 0.0261 0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4921 0.3609 -1.0789 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1711 0.7050 -0.7166 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6779 -0.1428 -0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2643 -1.2869 0.2322 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0532 0.2538 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8373 -0.5855 0.9264 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6234 1.8537 -0.1153 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.9246 -0.8688 0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5730 -0.0716 0.9997 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9271 0.9226 0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4741 -0.5094 -1.7852 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9338 1.2073 -1.6406 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4840 -1.5635 1.1785 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8334 -0.3009 1.1901 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