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
2.6401 -0.5112 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6103 0.3383 0.2336 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9321 1.5523 -0.1393 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2623 -0.2155 0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0188 -1.3845 0.4109 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7585 0.5121 -0.5443 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0328 -0.0534 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7099 -0.4653 0.5554 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9524 0.8941 1.6664 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.3761 -0.7291 1.9386 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6024 -1.5204 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6577 -0.1440 0.7366 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1484 2.1468 -0.6043 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9312 1.9286 0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0173 -0.9496 -1.3791 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6711 0.7554 -1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2568 -1.3512 1.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7431 -0.8033 0.2577 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