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
2.7823 -1.2599 0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4060 0.1333 0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3076 1.0638 -0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9834 0.5330 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6387 1.7304 -0.1183 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0376 -0.3770 0.2143 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3871 -0.0532 0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1591 -1.3623 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8944 0.5464 -1.0549 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7885 0.8615 1.3549 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0294 -2.0007 -0.0839 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9417 -1.4284 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7559 -1.4308 -0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0590 2.1054 -0.2683 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3480 0.7877 -0.1278 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1387 -1.6234 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1684 -1.3015 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6385 -2.2100 -0.0789 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9784 -0.2085 -1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3265 1.4415 -1.3678 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9359 0.9265 -0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1834 1.7615 1.4387 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7738 0.2289 2.2902 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8417 1.1361 1.1822 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