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
-2.7204 0.7127 0.2047 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6188 -0.2592 0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8653 -1.5361 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2683 0.1978 -0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0051 1.4181 -0.3222 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7721 -0.7035 -0.3154 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1152 -0.3604 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6299 0.5077 0.5313 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3431 0.9670 0.2433 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.6964 0.2455 0.3434 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7649 1.2660 -0.7796 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5072 1.4957 0.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8683 -1.8667 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1077 -2.3090 0.1227 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7523 -1.2777 -0.5817 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1623 0.1573 -1.5579 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0843 1.4429 0.6961 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5531 -0.0980 1.4818 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