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
-2.9881 -0.4960 -0.3118 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7341 0.1889 0.0815 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8112 1.3401 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4368 -0.3883 -0.2172 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3932 -1.5077 -0.8308 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7671 0.1714 0.1067 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0184 -0.4528 -0.2184 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1828 0.3513 0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6694 -0.5131 -0.2144 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.6696 0.1411 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5678 -0.8341 0.5756 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7792 -1.4000 -0.9326 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8919 1.8305 0.9939 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7557 1.8168 0.9604 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0012 -0.5843 -1.3199 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0813 -1.4669 0.2146 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1982 1.3314 -0.2811 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1090 0.4714 1.3424 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