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
    3.2474    0.2004   -1.3183 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9957    0.2187   -0.4608 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1958   -1.0274   -0.5747 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0635   -0.9435    0.2442 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9015   -0.0054    0.0540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8154    0.8214   -0.8701 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0565    0.0455    0.9342 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1506   -0.8243    1.9091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1424    1.0518    0.7710 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0395    0.5062   -2.3650 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7829   -0.7653   -1.2559 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9251    0.9748   -0.8877 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4300    1.0970   -0.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3364    0.3213    0.5864 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8655   -1.8802   -0.2815 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9248   -1.2674   -1.6391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3813   -1.5532    2.0412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9848   -0.8132    2.5713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3766    1.1804   -0.3213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0758    0.6542    1.2207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9218    2.0084    1.2590 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