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
-2.7565 -0.3037 -0.4451 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5288 0.0343 0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3391 -0.1363 -0.3965 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8874 0.1379 0.1906 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8511 0.5394 1.3907 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1551 -0.0088 -0.4808 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2697 0.2734 0.1509 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2857 -0.5577 -2.1367 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.2089 0.5896 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5024 -1.0881 -1.1881 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5069 -0.7233 0.2566 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4743 -0.6376 1.2282 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5687 1.0889 0.6694 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1841 0.6161 1.1852 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2525 0.1760 -0.3210 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