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
-2.0859 -1.1723 0.3259 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7885 0.2609 0.1068 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7987 1.1066 0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4199 0.7344 -0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2051 1.9482 -0.2474 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6500 -0.1236 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9550 0.3839 -0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9994 -0.7072 -0.1347 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6037 0.0235 -0.3598 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.1403 -1.3905 0.0303 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4584 -1.8456 -0.2937 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0113 -1.4552 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6333 2.1708 -0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8208 0.7898 0.1932 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0812 0.8676 -1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2215 1.1299 0.5713 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0124 -1.2329 0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8390 -1.4884 -0.9118 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