Monomers

Butyl methacrylate

Identifiers

IUPAC name
butyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3
InchI Key
SOGAXMICEFXMKE-UHFFFAOYSA-N
SMILES
CCCCOC(=O)C(=C)C
Canonical SMILES
CCCCOC(=O)C(=C)C
Isomeric SMILES
CCCCOC(=O)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
1.9058
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
    3.8277   -0.8856    0.2176 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4787   -0.2591    0.5373 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9780    0.4101   -0.6955 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6548    1.0767   -0.5429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3777    0.1974   -0.1742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6605    0.6971   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8384    1.9501   -0.1871 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7565   -0.1680    0.3790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5460   -1.4451    0.5635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1242    0.3569    0.5659 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2255   -0.4968   -0.7468 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7225   -1.9933    0.0689 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5245   -0.7365    1.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8269   -1.0724    0.8977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6553    0.5059    1.3255 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9294   -0.2880   -1.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7189    1.1910   -0.9832 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6649    1.9176    0.1739 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3741    1.4935   -1.5449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5494   -1.8352    0.4286 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3206   -2.1451    0.8473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0934    1.2908    1.1669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5104    0.6364   -0.4564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8042   -0.3984    0.9652 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  2  3
  8 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  3 16  1  0
  3 17  1  0
  4 18  1  0
  4 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