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
    2.5092   -0.6382    0.7712 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4693    0.6951    0.1087 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4817    0.9348   -0.9603 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1373    0.8584   -0.6961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6426   -0.1951   -0.3629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1353   -1.3358   -0.2696 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0917   -0.0627   -0.0987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6964    1.1065   -0.1776 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9052   -1.2433    0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5084   -0.7881    1.3016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4849   -1.4487    0.0169 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7337   -0.8228    1.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5187    0.8642   -0.2936 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3766    1.4635    0.9325 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7640    0.1912   -1.7988 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6919    1.9250   -1.4955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1634    2.0178   -0.4378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7531    1.2153    0.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3640   -1.1166    1.2879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6776   -1.4831   -0.4988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2464   -2.1373    0.3521 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