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
-1.8332 1.1616 1.3166 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8112 0.0321 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9559 -0.5174 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5596 -0.4947 -0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5535 -1.4673 -0.9674 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6629 0.0452 0.1997 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8483 -0.4963 -0.3403 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0800 0.1911 0.1392 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4792 -0.6239 -0.6444 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.2411 0.9194 2.2298 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3991 2.0982 0.8904 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8475 1.3966 1.6374 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9137 -0.1667 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9534 -1.3436 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8961 -1.5560 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7594 -0.4536 -1.4377 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1310 1.2586 -0.1163 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2113 0.0167 1.2325 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