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
3.4302 -0.4658 -0.5214 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2839 0.2496 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5504 1.2823 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9110 -0.1779 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7237 -1.1642 -0.9257 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1817 0.4536 0.3664 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4974 0.0089 0.0885 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7195 0.0960 -1.3863 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7360 -1.3710 0.6483 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4820 0.9413 0.7685 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1376 -0.9811 -1.4564 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2147 0.2848 -0.7392 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8275 -1.2598 0.1762 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5565 1.6075 1.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7406 1.8173 1.3226 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7879 0.2404 -1.6622 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3634 -0.8308 -1.9209 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0841 0.9177 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9843 -1.5296 1.4621 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7281 -1.4752 1.1346 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5702 -2.1278 -0.1418 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2008 1.9732 0.5561 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5442 0.7409 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4965 0.7699 0.3134 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