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
-2.5586 -0.9135 1.2578 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6608 -0.1435 0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1530 0.4046 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2220 0.0282 0.7216 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2113 -0.5066 1.7636 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6233 0.7320 -0.0565 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9664 0.9858 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9285 -0.1403 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7263 -1.3684 1.2554 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.0748 -1.6542 1.8979 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2656 -1.4805 0.5857 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2233 -0.2079 1.8268 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2007 0.2894 -0.9464 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4663 0.9694 -1.3139 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2312 1.7813 -0.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1859 1.5307 1.0607 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9846 -0.5938 -1.0108 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9679 0.2872 0.1681 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