Monomers

Methyl 2-(propoxymethyl)prop-2-enoate

Identifiers

IUPAC name
methyl 2-(propoxymethyl)prop-2-enoate
InchI
InChI=1S/C8H14O3/c1-4-5-11-6-7(2)8(9)10-3/h2,4-6H2,1,3H3
InchI Key
OVZWLGCWEYISAY-UHFFFAOYSA-N
SMILES
CCCOCC(=C)C(=O)OC
Canonical SMILES
CCCOCC(=C)C(=O)OC
Isomeric SMILES
CCCOCC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O3
Heavy Atom Count
11
Molecular Weight
158.197
Exact Molecular Weight
158.0943
Valence Electrons
64
Radical Electrons
0
tPSA
35.53
MolLogP
1.1422
H Bond Acceptors
3
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

 25 24  0  0  0  0  0  0  0  0999 V2000
    4.2071    0.6174   -0.2184 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2616   -0.4769    0.2041 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8466   -0.2131   -0.2876 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0412   -1.2389    0.1277 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2662   -1.1898   -0.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1383   -0.2286    0.5038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    0.6194    1.4134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5838   -0.2306    0.0988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0129   -1.0219   -0.7685 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4728    0.6508    0.6836 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8464    0.6965    0.3437 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1833    0.1318   -0.4650 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8544    1.1862   -1.0982 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3683    1.3553    0.5922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2281   -0.4664    1.3195 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5742   -1.4332   -0.2218 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4961    0.7484    0.0209 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9528   -0.2779   -1.4218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6925   -2.2246    0.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3829   -1.1488   -1.2909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4972    1.3005    1.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2299    0.6902    1.7973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0171    0.1395   -0.6233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4914    0.2397    1.1253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0922    1.7752    0.1931 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  1  0
  6  7  2  3
  6  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  3 17  1  0
  3 18  1  0
  5 19  1  0
  5 20  1  0
  7 21  1  0
  7 22  1  0
 11 23  1  0
 11 24  1  0
 11 25  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers