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
-2.8491 0.7445 0.9517 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7213 0.2486 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9349 -0.2020 -1.0785 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3668 0.2444 0.6464 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1526 0.6804 1.8257 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7069 -0.2166 -0.1012 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9825 -0.1791 0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0571 -0.7034 -0.4239 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6059 -0.5824 0.4753 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.7667 0.4342 2.0206 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8273 0.3227 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9458 1.8328 0.8949 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9378 -0.2148 -1.4958 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1555 -0.5767 -1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9549 -0.8454 1.3852 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2625 0.8559 0.7645 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9307 -1.7752 -0.6641 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1574 -0.0679 -1.3365 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