Monomers
2-Bromoethyl methacrylate
Identifiers
IUPAC name
2-bromoethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H9BrO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3
InchI Key
AOUSBQVEVZBMNI-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCCBr
Canonical SMILES
CC(=C)C(=O)OCCBr
Isomeric SMILES
CC(=C)C(=O)OCCBr
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H9BrO2
Heavy Atom Count
9
Molecular Weight
193.04
Exact Molecular Weight
191.9786
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5006
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
2.2406 -0.9880 -0.0844 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7997 0.3646 -0.4286 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6888 1.3058 -0.6962 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3793 0.7126 -0.4864 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0082 1.8786 -0.7833 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6233 -0.2085 -0.2214 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9942 0.1929 -0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9277 -0.9257 0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7329 -0.2405 -0.1165 Br 0 0 0 0 0 0 0 0 0 0 0 0
1.3808 -1.6812 -0.2021 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5354 -1.0113 0.9994 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0636 -1.3663 -0.7106 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3832 2.3228 -0.9556 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7506 1.1355 -0.6765 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2552 0.5842 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1516 1.0079 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7442 -1.3797 1.0187 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8008 -1.7039 -0.7879 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