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
-2.2950 -0.9356 -0.4451 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6655 0.1973 0.2814 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4359 1.1015 0.8223 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1983 0.2788 0.3773 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3745 1.2139 0.9787 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5772 -0.6991 -0.2094 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9680 -0.6891 -0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6280 0.4977 -0.7902 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4127 0.3245 -0.6318 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.3357 -0.7764 -1.5384 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2707 -1.2137 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6128 -1.8202 -0.2859 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0157 1.9419 1.3599 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5060 1.0466 0.7553 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3517 -0.8661 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3118 -1.6118 -0.7183 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3354 1.4088 -0.2323 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3762 0.6012 -1.8472 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