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
   -3.6715   -0.3966   -0.8974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5787    0.6027   -0.5683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0721    0.2527    0.8279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0892    1.0602    1.2634 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0763    1.1893    0.6299 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0284    0.0576    0.5873 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8605   -1.1058    1.1347 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3101    0.2574   -0.1528 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5562    1.3354   -0.7066 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2074   -0.7807   -0.2043 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4555   -0.6819   -0.8870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3365   -1.1639   -1.6265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5623    0.1108   -1.3174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0234   -0.9270    0.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0438    1.6001   -0.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8022    0.4802   -1.3311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9700   -0.8252    0.8642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9787    0.4796    1.4870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0012    1.6411   -0.4026 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6455    2.0202    1.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6168   -1.8679    1.0436 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0039   -1.3556    1.7057 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4021    0.0412   -1.7121 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7446   -1.7062   -1.2054 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2226   -0.3178   -0.1457 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