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
   -2.4728    0.9413   -0.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4548   -0.5182    0.2239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3903   -1.3376   -0.3856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0824   -1.1390   -0.0820 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6793   -0.0509   -0.3634 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1986    0.9150   -0.9784 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0887    0.0625    0.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6697   -0.9175    0.6807 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8414    1.2820   -0.3200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4298    1.2645   -1.0536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5170    1.2868    0.3462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7966    1.4490    0.6944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4371   -0.9490   -0.1668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5302   -0.7103    1.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5719   -1.3738   -1.5163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6293   -2.4191   -0.0865 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1019   -1.7943    0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6990   -0.8686    0.9822 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9256    1.1600   -0.2424 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4961    2.0950    0.3819 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6121    1.6224   -1.3667 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