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
   -2.5536    0.7767    0.7441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4025   -0.6780    0.4516 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4355   -1.0821   -0.5972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1034   -0.7954   -0.4472 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6286    0.3326   -0.3972 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0260    1.4223   -0.5183 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0809    0.3726   -0.2110 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6638    1.5524   -0.1823 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8986   -0.8584   -0.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7843    1.1845    1.4137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5743    0.9652    1.2327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6028    1.4015   -0.1671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4309   -1.0223    0.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2473   -1.2510    1.4073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4861   -2.2195   -0.7190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8553   -0.7358   -1.5896 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1224    2.4727   -0.2888 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7325    1.6337   -0.0474 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3713   -1.6742   -0.5664 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0894   -1.0861    1.0256 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8626   -0.7113   -0.5715 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