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
-2.1345 1.2077 0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6318 -0.1773 0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4691 -1.1728 0.2136 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2148 -0.4094 0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1920 -1.5811 0.4332 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6573 0.6446 0.2806 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0266 0.4892 0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5360 -0.3214 -0.7593 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2965 -0.5285 -0.6510 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.0328 1.3967 0.6584 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4198 1.3350 -1.0267 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3532 1.9677 0.2628 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1041 -2.1878 0.3234 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5450 -1.0602 0.1292 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3553 0.0432 1.3528 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5057 1.5044 0.3577 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2346 0.1801 -1.7066 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1010 -1.3301 -0.7890 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