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
-2.2885 0.0177 -0.2427 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4715 -1.0179 0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2013 -0.4984 0.8372 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7113 -0.0542 -0.0997 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4284 -0.1019 -1.3047 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9722 0.4533 0.3681 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8616 0.8834 -0.4983 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3211 0.4993 2.0657 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.4245 -0.3423 -1.2835 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7965 1.0082 -0.1827 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3121 0.1283 0.1767 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3334 -1.9443 -0.0557 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9989 -1.1879 1.4801 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6945 0.8769 -1.5694 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8377 1.2798 -0.1943 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