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
-2.1293 0.4508 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2643 0.1941 -0.9589 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0703 0.2804 -0.5522 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5189 -0.5901 0.4202 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3085 -1.4116 0.8815 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8981 -0.5619 0.8972 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7157 0.3147 0.3811 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4509 -1.6805 2.1378 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.5288 0.9046 1.0998 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9701 1.1417 0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5125 -0.5218 0.6361 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5288 -0.7991 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5369 0.9447 -1.7277 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7395 0.3448 0.7267 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3859 0.9890 -0.3655 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