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
-2.3468 -0.7697 -0.5507 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6295 0.4730 -0.2519 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2449 1.6220 -0.4069 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2275 0.4762 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3292 1.5658 0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4989 -0.6482 0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7955 -0.8495 0.8346 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8930 -0.3289 -0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9305 1.3885 -0.3242 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.7716 -1.6824 -0.3464 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6994 -0.7131 -1.6011 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2903 -0.7547 0.0708 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7378 2.5594 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2649 1.6365 -0.7504 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9945 -1.9673 0.9162 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9959 -0.4584 1.8681 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -0.9375 -0.9777 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8621 -0.6116 0.4610 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