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
-2.4318 0.3987 0.5982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6008 -0.4468 -0.2867 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1429 -1.4241 -0.9582 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1610 -0.2116 -0.4316 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5452 -0.9251 -1.1798 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4375 0.8145 0.2665 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8064 1.0747 0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6963 -0.0468 0.5977 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3825 0.5195 0.3745 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.4603 0.5219 0.2037 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9558 1.3696 0.8378 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5150 -0.1411 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5327 -2.0415 -1.6052 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2169 -1.5977 -0.8486 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0905 1.4507 -0.8612 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0165 1.9305 0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5450 -0.2848 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4973 -0.9604 0.0472 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