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
    2.8623    0.5154   -0.5593 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5714   -0.1732    0.7578 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3023   -0.9672    0.6908 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1742   -0.1526    0.3868 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0833   -0.7297    0.2867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1539   -1.9716    0.4754 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2704    0.0310   -0.0177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4436   -0.5369   -0.1064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1550    1.4821   -0.2332 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1064   -0.2837   -1.2971 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0576    1.1852   -0.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7748    1.1552   -0.3808 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5792    0.5707    1.5733 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4003   -0.8920    0.9244 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4330   -1.7787   -0.0476 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0959   -1.4107    1.6851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5269   -1.6229    0.0553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3650   -0.0401   -0.3276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3168    1.7345   -0.9061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9289    1.9391    0.7734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1137    1.9460   -0.5603 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