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
    4.0089    0.0267   -0.8691 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1083    1.0453   -0.2569 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8637    0.3992    0.3645 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1883   -0.2568   -0.6204 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0234   -0.8551   -0.2862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286   -0.0074    0.0236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1454    1.2855   -0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3739   -0.7041    0.4052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3834   -1.9479    0.4441 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5205   -0.0245    0.7184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7435   -0.6469    1.0914 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1708    0.2295   -1.9676 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5773   -0.9791   -0.8092 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0325    0.0469   -0.4298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7672    1.8004   -0.9943 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6214    1.5804    0.5682 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2984   -0.4005    1.0486 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2499    1.0726    0.9265 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2064   -1.5069    0.6366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2617   -1.5708   -1.1107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0903    1.7945    0.2538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3539    1.9466   -0.2890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5901   -1.7229    1.2246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0578   -0.1787    2.0615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4675   -0.4263    0.2813 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