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
-2.1513 -0.9747 -0.7039 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6405 0.2182 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4285 1.2215 0.2752 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2465 0.2580 0.3762 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1593 1.2929 0.9756 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5874 -0.8049 0.0826 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9271 -0.7673 0.4416 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6296 0.3762 -0.2461 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3650 0.3940 0.2340 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.4127 -1.7818 -0.7822 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5747 -0.7215 -1.6968 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9893 -1.3875 -0.0704 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4791 1.2607 0.0234 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0474 2.1049 0.7958 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0147 -0.6246 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4819 -1.7011 0.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2471 1.3700 0.0365 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5579 0.2669 -1.3556 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