Monomers
2-Chloroethyl methacrylate
Identifiers
IUPAC name
2-chloroethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H9ClO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3
InchI Key
GPOGMJLHWQHEGF-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCCCl
Canonical SMILES
CC(=C)C(=O)OCCCl
Isomeric SMILES
CC(=C)C(=O)OCCCl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H9ClO2
Heavy Atom Count
9
Molecular Weight
148.589
Exact Molecular Weight
148.0291
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.3445
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
18 17 0 0 0 0 0 0 0 0999 V2000
-2.6396 -0.6461 -0.5822 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6163 0.0981 0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9700 1.1171 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2209 -0.2867 0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1460 -1.2779 -0.6156 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7879 0.3701 0.7836 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1146 -0.0391 0.6814 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7020 -0.0005 -0.6918 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6830 1.6263 -1.3909 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.2219 -1.4126 -1.2517 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3339 -1.1920 0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2996 0.0249 -1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0045 1.4435 0.9965 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2367 1.6745 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2912 -1.0662 1.0857 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7413 0.6266 1.3363 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7899 -0.2849 -0.5754 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2876 -0.7751 -1.3618 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 1 0
8 9 1 0
1 10 1 0
1 11 1 0
1 12 1 0
3 13 1 0
3 14 1 0
7 15 1 0
7 16 1 0
8 17 1 0
8 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers