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
    2.6028   -0.4035   -1.3520 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3462    0.2717   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3130    0.7769    0.6694 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9774    0.3582    0.4359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7056    0.9153    1.5304 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0382   -0.1662   -0.2998 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4049   -0.1483    0.0504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6698   -0.8607    1.3545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9273    1.2814    0.1673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1361   -0.8221   -1.0952 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4458    0.0880   -1.8935 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6809   -0.4673   -1.9600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8603   -1.4711   -1.0904 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1162    1.2579    1.6060 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3304    0.7233    0.3340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4458   -0.3479    1.9700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0082   -1.9053    1.1117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7725   -0.9623    1.9839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7626    1.8406   -0.7721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4440    1.8138    0.9991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0071    1.2047    0.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5020   -1.7079   -1.3710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1574   -1.1313   -0.8107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1025   -0.1378   -1.9539 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