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
-2.1905 0.4497 -0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4966 -0.8435 -0.4135 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1027 -0.6569 -0.1950 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6422 0.2965 -0.8302 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0929 1.0675 -1.6604 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0762 0.4253 -0.5497 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6495 -0.3824 0.3194 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0639 1.6311 -1.3407 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.2329 0.2202 0.2118 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6468 0.8931 0.8017 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1376 1.1524 -0.8948 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6970 -1.1491 -1.4562 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8189 -1.6437 0.2916 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1028 -1.1563 0.8511 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6954 -0.3041 0.5378 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