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
-2.9976 0.3560 -0.3138 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7208 -0.2718 0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7626 -1.3918 0.8675 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4540 0.3559 -0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4610 1.4100 -0.8998 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7668 -0.1765 0.1766 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9526 0.5063 -0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1882 -0.1954 0.2821 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5946 0.7498 -0.2771 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.1891 1.2928 0.2653 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8531 -0.3206 -0.2234 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8114 0.6565 -1.3825 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6970 -1.8288 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8358 -1.8279 1.1861 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9404 0.6037 -1.3254 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9269 1.5283 0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2566 -1.2394 -0.0476 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1564 -0.2070 1.3910 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