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
   -3.6863    0.1108   -0.6546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4713    0.7653   -0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2945   -0.1249   -0.3071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0869    0.3611    0.2392 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0435   -0.4166   -0.0050 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9437   -1.4944   -0.6862 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3605   -0.0455    0.4933 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5185    1.0476    1.1959 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5439   -0.8879    0.2205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7695    0.4702   -1.7171 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5427   -0.9730   -0.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5678    0.4279   -0.0840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3343    1.7985   -0.3211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6620    0.7034    1.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4925   -1.1345    0.1090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1391   -0.2531   -1.3902 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6601    1.6704    1.4012 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4835    1.3170    1.5596 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3537   -0.6632    0.9456 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2618   -1.9650    0.3533 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8777   -0.7144   -0.8323 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