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
    3.5432   -0.4339   -0.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0610   -0.7243   -0.2057 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3009    0.5340   -0.5536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0812    0.3637   -0.5534 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8430   -0.0309    0.5256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2394   -0.2573    1.6043 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2997   -0.1909    0.4559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9527   -0.5703    1.5280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0243    0.0750   -0.8185 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7399    0.6028   -0.5958 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0058   -0.5006    0.7780 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0804   -1.1292   -0.9328 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8104   -1.5683   -0.8836 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8222   -1.0720    0.8200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6677    1.3303    0.1082 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6007    0.8253   -1.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4301   -0.7607    2.4420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0176   -0.6911    1.4912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1104   -0.0285   -0.6404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8842    1.1494   -1.1391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7494   -0.6313   -1.6056 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