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
-2.3468 0.9980 -0.1421 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5100 -0.2551 0.0364 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1407 0.0581 -0.0819 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7784 -0.9795 0.0553 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3761 -2.1274 0.2734 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1972 -0.6743 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6446 0.5346 -0.2948 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3563 -1.9771 0.1081 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.8439 1.8166 0.3815 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3672 0.8902 0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3925 1.2516 -1.2266 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6893 -0.7172 1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7476 -0.9653 -0.7899 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6970 0.7447 -0.3804 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9885 1.4021 -0.4147 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