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
   -3.7110    0.2829   -0.1417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4859    0.4370    0.7108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2908    0.0041   -0.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0909    0.1200    0.6201 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0866   -0.2461   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0160   -0.6550   -1.2078 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3815   -0.1781    0.6092 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4918    0.2422    1.8409 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5735   -0.5859   -0.1467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5860   -0.5580   -0.8383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5630    0.0756    0.5303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8436    1.2067   -0.7340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5482   -0.1336    1.6666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3711    1.4997    0.9998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2437    0.6889   -0.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4354   -1.0515   -0.4358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4259    0.3213    2.3818 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6071    0.5380    2.3822 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7491   -1.6728   -0.0684 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3814   -0.3532   -1.2324 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4567    0.0176    0.1342 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