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
    3.6525    0.2246    0.4371 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2444    0.5972    0.1114 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2755   -0.5595    0.3779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0104   -0.0835    0.0334 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1608   -0.8200    0.1287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0471   -1.9992    0.5540 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4231   -0.2295   -0.2523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5262   -0.9308   -0.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4649    1.1563   -0.7392 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6491   -0.8513    0.7487 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2847    0.3836   -0.4451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9977    0.8465    1.2874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8944    1.4394    0.7336 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1249    0.8445   -0.9659 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5793   -1.4488   -0.1777 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3116   -0.8198    1.4708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4795   -0.5007   -0.4449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4750   -1.9444    0.1965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7868    1.8568    0.0801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1884    1.3056   -1.5781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4518    1.5332   -1.0405 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