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
    2.9273   -0.6634   -0.4045 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2791    0.5603    0.1149 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0211    1.5745    0.4866 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.5861    0.1921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2848    1.6497    0.6424 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0333   -0.4759   -0.1965 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3711   -0.3556   -0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8802    0.8084   -0.9148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7382   -0.1676    1.3628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0682   -1.6065   -0.5890 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3933   -1.2479    0.4360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7427   -0.4258   -1.1285 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1788   -1.3541   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0910    1.5079    0.4108 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5256    2.4543    0.8614 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8214    0.5666   -1.4419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0677    1.6961   -0.2792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1352    1.0745   -1.7105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5180    0.6085    1.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8202    0.0563    1.9290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1211   -1.1343    1.7611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5655   -2.5111   -0.1884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1049   -1.6149   -1.6913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0902   -1.5859   -0.2050 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