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
   -3.5221   -0.4438    0.8956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2749   -0.3693   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8653    1.0450   -0.0461 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7950    1.4873   -0.7212 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3907    0.9549   -0.3775 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8598   -0.3048   -0.9056 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2637   -1.0611   -1.7656 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1702   -0.7760   -0.4006 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6776   -1.8507   -0.7844 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9009   -0.0466    0.5252 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1622   -0.5062    1.0072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6990   -1.4659    1.2447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3576   -0.0337    0.2854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3859    0.2353    1.7631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4983   -0.9825    0.4652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5357   -0.8296   -0.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7954    1.6428   -0.3839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7932    1.3644    1.0620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1562    1.7972   -0.5999 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5080    0.9004    0.7617 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6763   -2.0140   -2.1226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6614   -0.7777   -2.2249 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6579    0.3062    1.5481 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9622   -1.4053    1.6220 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7980   -0.8388    0.1578 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