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
    2.6568    0.7942    0.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4307   -0.6460   -0.1773 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2256   -1.0477   -0.9384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0208   -0.7767   -0.4470 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7038    0.3561   -0.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1581    1.4506   -0.4584 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0726    0.3861    0.3584 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6962    1.5248    0.5793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7628   -0.8826    0.6797 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0688    1.1160    0.9727 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7357    0.9797    0.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4800    1.4544   -0.7621 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3205   -0.9991   -0.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5483   -1.2711    0.7641 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2699   -0.6311   -2.0064 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3689   -2.1601   -1.1515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1824    2.4409    0.3410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6805    1.5638    0.9814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4690   -1.1891   -0.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3543   -0.7807    1.6033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0048   -1.6825    0.7374 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