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
-2.4431 -0.5352 -1.5073 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1520 0.0398 -1.0639 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5509 0.9374 -1.8098 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5300 -0.3679 0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1108 -1.2274 0.8936 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6760 0.1491 0.6291 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1922 -0.3164 1.8576 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5053 0.3430 2.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3836 2.0893 2.3385 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.2912 -1.5468 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1431 -0.6198 -0.6449 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9114 0.1615 -2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3874 1.3558 -1.4884 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9550 1.2869 -2.7489 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4237 -1.4055 1.6984 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4609 -0.2881 2.6803 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2453 0.0026 1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8131 -0.0585 3.1980 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