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
    3.0771    1.1872   -1.8489 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8912    1.0715   -0.9038 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3544   -0.2937   -0.9561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2841   -0.6633   -0.2002 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9817   -0.1885   -0.1734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1946    0.7412   -0.9769 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9794   -0.7420    0.7300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6375   -1.7212    1.5319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3703   -0.2313    0.7697 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4079    2.2446   -1.8794 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8910    0.4949   -1.5683 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6942    0.9469   -2.8650 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3250    1.2876    0.1180 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2381    1.8977   -1.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0851   -0.5235   -2.0332 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1816   -1.0099   -0.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3825   -2.1229    2.1955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6512   -2.1242    1.5424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8766   -0.5722    1.6850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9717   -0.5716   -0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3843    0.8927    0.7590 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