Monomers

N-Propyl methacrylate

Identifiers

IUPAC name
propyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h2,4-5H2,1,3H3
InchI Key
NHARPDSAXCBDDR-UHFFFAOYSA-N
SMILES
CCCOC(=O)C(=C)C
Canonical SMILES
CCCOC(=O)C(=C)C
Isomeric SMILES
CCCOC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O2
Heavy Atom Count
9
Molecular Weight
128.171
Exact Molecular Weight
128.0837
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5157
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

 21 20  0  0  0  0  0  0  0  0999 V2000
   -2.6125    0.7312   -0.1784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3131   -0.6204    0.3425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2535   -1.4291   -0.3146 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0055   -0.8882   -0.2694 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5924    0.1857   -0.8113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0441    0.9484   -1.5633 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4682   -0.5170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5779    1.5221   -1.0483 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7878   -0.4238    0.3778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9284    1.5169    0.1957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6337    1.0944    0.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6545    0.8145   -1.2851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2931   -1.2095    0.3816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0987   -0.5073    1.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5527   -1.7140   -1.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2046   -2.4102    0.2719 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6153    1.7510   -0.8458 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0509    2.1976   -1.7016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3702   -1.4517    0.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8454   -0.4839    0.0146 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7434   -0.0921    1.4355 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  2  0
  5  7  1  0
  7  8  2  3
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers