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
-2.7843 -0.1913 -0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4785 0.3038 -0.8333 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3836 -0.2196 -0.0703 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9113 0.1301 -0.4307 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0554 0.8954 -1.4176 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0874 -0.3307 0.2568 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2835 0.0278 -0.1223 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9069 -1.3898 1.6243 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.3303 0.6044 0.2568 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5811 -1.0539 0.3765 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4410 -0.5180 -1.1145 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4431 1.4078 -0.8818 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3690 -0.0570 -1.8906 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1991 -0.3001 0.3727 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3673 0.6912 -0.9809 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