Monomers
tert-Butyl methacrylate
Identifiers
IUPAC name
tert-butyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O2/c1-6(2)7(9)10-8(3,4)5/h1H2,2-5H3
InchI Key
SJMYWORNLPSJQO-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OC(C)(C)C
Canonical SMILES
CC(=C)C(=O)OC(C)(C)C
Isomeric SMILES
CC(=C)C(=O)OC(C)(C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H14O2
Heavy Atom Count
10
Molecular Weight
142.198
Exact Molecular Weight
142.0994
Valence Electrons
58
Radical Electrons
0
tPSA
26.3
MolLogP
1.9042
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
24 23 0 0 0 0 0 0 0 0999 V2000
3.3467 0.9087 0.6946 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3314 0.0866 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7457 -0.8217 -0.8692 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8935 0.2992 0.2438 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4965 1.1670 1.0592 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0800 -0.4470 -0.3988 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4327 -0.2317 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8931 1.1711 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8376 -0.5599 1.2736 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2206 -1.1757 -1.0528 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5230 0.4805 1.7185 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0058 1.9737 0.7556 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3001 0.9305 0.1404 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0894 -1.4678 -1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7980 -0.9474 -1.0316 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0781 1.7127 -0.9854 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1059 1.7482 0.4867 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8071 1.1754 -1.0882 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7832 0.3431 1.9218 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9133 -0.8589 1.2588 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2709 -1.4135 1.6818 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2546 -1.1552 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7327 -2.1666 -0.9786 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1201 -0.7513 -2.0810 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
7 9 1 0
7 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
3 14 1 0
3 15 1 0
8 16 1 0
8 17 1 0
8 18 1 0
9 19 1 0
9 20 1 0
9 21 1 0
10 22 1 0
10 23 1 0
10 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers