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
    3.6744   -0.0080   -0.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2743    0.5971   -0.3321 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2957   -0.5678   -0.1434 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0019   -0.0332   -0.1931 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1600   -0.7753   -0.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0320   -2.0129    0.1144 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4700   -0.1400   -0.1254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5647   -0.8560    0.0011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5866    1.3193   -0.3334 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3427    0.7827    0.1008 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9771   -0.3532   -1.3028 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6624   -0.8779    0.4013 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1657    1.0764   -1.3094 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1552    1.3417    0.4525 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4754   -0.9305    0.9106 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4920   -1.3570   -0.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5334   -0.3907   -0.0455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5428   -1.9236    0.1546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5569    1.7273   -0.0441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7781    1.7866    0.3010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2922    1.5951   -1.3880 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