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
    3.7699   -0.4388   -0.1808 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3421   -0.3384   -0.6547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3843   -0.0913    0.5185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0915   -0.0164   -0.0434 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0567    0.1953    0.6619 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9767    0.3366    1.9064 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3921    0.2659    0.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5218    0.1236   -1.2732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6062    0.4986    0.8447 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8671   -0.4067    0.9147 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3747    0.3700   -0.6626 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2418   -1.3953   -0.5156 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2398    0.4514   -1.4218 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0679   -1.2946   -1.1445 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6952    0.8331    1.0145 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5005   -0.9258    1.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6509   -0.0462   -1.8849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4978    0.1787   -1.7098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3999    0.4849    1.9271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0774    1.4782    0.5434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3953   -0.2627    0.6655 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