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
   -2.4971   -0.1879    1.1635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5137    0.4697   -0.1877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5020    0.0444   -1.1618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1737    0.1848   -0.9426 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7054   -0.3116   -0.0456 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2564   -1.0994    0.8126 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1194    0.0261   -0.0391 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5712    0.8579   -0.9520 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9939   -0.5703    0.9828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7897    0.2805    1.8844 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5120   -0.0555    1.6745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4066   -1.2894    1.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5263    0.2025   -0.6289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6014    1.5910   -0.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7265    0.5798   -2.1436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7451   -1.0358   -1.4372 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9727    1.3092   -1.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6240    1.1056   -0.9425 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6922    0.2137    1.3603 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6226   -1.3785    0.5453 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4361   -0.9368    1.8602 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