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
-2.1889 -0.2436 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3884 0.6095 -0.7929 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0704 0.6830 -0.2993 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6601 -0.4832 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0926 -1.5520 -0.4787 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0416 -0.4370 0.3591 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6112 0.6989 0.6907 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8731 -1.9777 0.5005 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.6885 -0.3223 1.1181 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2316 -1.2837 -0.2766 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2346 0.1082 0.2097 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7661 1.6611 -0.8541 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4206 0.2138 -1.8442 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0940 1.6348 0.6004 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6165 0.6904 1.0603 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