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
    3.5977    0.0660    0.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1360    0.1014    0.4295 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3252    0.7278   -0.6835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0427    0.7929   -0.3970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8708   -0.2750   -0.1392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3725   -1.4288   -0.1580 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2928   -0.1390    0.1539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8607    1.0560    0.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1590   -1.3125    0.4279 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9752   -0.9668   -0.1005 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8032    0.6300   -0.8831 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2244    0.5415    0.8612 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7339   -0.8845    0.6788 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0014    0.7846    1.3193 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5524    0.1537   -1.6096 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6884    1.7789   -0.7980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9169    1.1941    0.3993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2367    1.9233   -0.0146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6211   -2.1622    0.8531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9465   -1.0239    1.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7178   -1.5572   -0.5075 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