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
    2.4869    1.3659    0.6298 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4995    0.7613   -0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6482   -0.5158   -0.7763 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3423   -0.1516   -0.4146 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7241   -1.0002   -0.3129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5532   -2.2116   -0.5569 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0252   -0.4472    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1636    0.8272    0.3270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2334   -1.3122    0.2113 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6306    0.5761    1.3944 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5216    1.9049    0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2826    2.1293    0.6763 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5321    0.5447   -1.0989 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0614    1.5211   -1.4354 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7273   -1.0243   -1.7469 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0219   -1.2089    0.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3157    1.4753    0.2416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1088    1.2315    0.6126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9951   -0.8778   -0.4918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0452   -2.3521   -0.1039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5901   -1.2355    1.2607 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