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
-1.5582 1.1698 0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1224 -0.2506 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9521 -1.2614 -0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3289 -0.5158 0.0381 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7773 -1.6892 -0.0048 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2580 0.5159 0.0924 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6563 0.2904 0.1007 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0302 -0.5774 -1.4247 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.5186 1.3167 -0.4864 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8000 1.7628 -0.4783 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6094 1.5494 1.1098 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5913 -2.2630 -0.0583 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0055 -1.0858 -0.0276 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1311 1.3130 0.0627 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9760 -0.2749 0.9833 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