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
   -3.4585   -0.4866    0.3292 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0443   -0.4986   -0.2538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4128    0.7968    0.1555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1050    0.9125   -0.3265 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8819    0.0375    0.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6408   -0.8931    0.8625 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2143    0.2090   -0.4815 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4734    1.1754   -1.3184 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2796   -0.7275   -0.0718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9710   -1.4486    0.1770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3365   -0.2430    1.4103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9994    0.3256   -0.1967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4578   -1.3349    0.1441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0759   -0.5692   -1.3569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9693    1.6766   -0.2477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4502    0.9508    1.2666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4595    1.3127   -1.7265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6932    1.8538   -1.6126 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1027   -1.1050    0.9416 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2990   -0.3119   -0.2140 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2365   -1.6324   -0.7454 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