Monomers
Chloromethyl methacrylate
Identifiers
IUPAC name
chloromethyl 2-methylprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-4(2)5(7)8-3-6/h1,3H2,2H3
InchI Key
JNNKWUPPLJTSSJ-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCCl
Canonical SMILES
CC(=C)C(=O)OCCl
Isomeric SMILES
CC(=C)C(=O)OCCl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
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
15 14 0 0 0 0 0 0 0 0999 V2000
-2.0566 1.1161 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0803 -0.0126 0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4909 -1.2625 0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3448 0.3186 0.1314 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7442 1.5104 0.1101 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3279 -0.6623 0.1787 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7080 -0.3591 0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6215 -1.8805 0.2618 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.9636 0.8918 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2942 1.2910 -1.0166 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5771 2.0449 0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5434 -1.4633 0.1114 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7489 -2.0400 0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0069 0.2391 1.0843 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0016 0.2682 -0.6873 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
1 9 1 0
1 10 1 0
1 11 1 0
3 12 1 0
3 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers