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
    3.7355   -0.6097    0.0329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3074   -1.1130   -0.0147 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4045    0.0723   -0.0087 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0247   -0.2966   -0.0518 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9884    0.6358   -0.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6559    1.8432   -0.0175 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3993    0.3033   -0.0977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8290   -0.9620   -0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4006    1.3878   -0.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8369    0.3157   -0.5936 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9725   -0.2975    1.0772 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4686   -1.3847   -0.2680 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1543   -1.7284   -0.9343 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1150   -1.7315    0.9012 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6267    0.7769   -0.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5447    0.6175    0.9589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1425   -1.7959   -0.1415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8827   -1.1919   -0.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2691    2.0707   -0.9833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4312    1.0480   -0.0514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1920    2.0401    0.7992 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