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
2.6212 0.4417 1.0843 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6724 0.1493 0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0429 0.1817 -1.2385 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2531 -0.1962 0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1211 -0.2324 1.4757 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6328 -0.4685 -0.7045 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9504 -0.7861 -0.5895 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9180 0.1899 -0.0457 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6432 0.7346 1.6053 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.1571 0.5528 2.0777 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1282 1.4059 0.8547 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4382 -0.3150 1.1439 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3727 -0.0282 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0673 0.4294 -1.4692 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1389 -1.7527 -0.0268 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3191 -1.0338 -1.6435 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9266 -0.3336 -0.0295 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1030 1.0609 -0.7235 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