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
Resources
cid=

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
    2.8556    0.8165   -0.9175 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3563    0.0349    0.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2334   -0.4531    1.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9364   -0.2178    0.4659 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5504   -0.8887    1.4572 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0571    0.2574   -0.3749 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4350    0.0159   -0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9215    0.5556    1.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7038   -1.4795   -0.1945 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2229    0.6784   -1.2600 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4038    1.7216   -0.5505 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0954    1.0877   -1.6481 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6608    0.1836   -1.3956 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2912   -0.2957    0.9531 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9019   -1.0212    1.9188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0336    0.6895    1.0596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7622   -0.2218    1.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4943    1.5313    1.4259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7712   -2.0038   -0.5032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9725   -1.8759    0.7993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5507   -1.7189   -0.8784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5813    0.9886   -2.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0522   -0.0025   -1.5941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7270    1.6179   -0.8948 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