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
   -4.1954    0.1523    0.1660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7636   -0.3575    0.3421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7992    0.7845    0.4053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5212    0.3312    0.5982 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0979   -0.4865   -0.4241 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3340   -0.8283   -0.0666 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7052   -2.0791    0.1231 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2735    0.2431    0.0598 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8832    1.4236   -0.1285 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6149    0.0696    0.3824 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4236    1.2236    0.4718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3249    0.4074   -0.9124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9039   -0.6526    0.4657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3901    1.0548    0.7481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5197   -0.9789   -0.5677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6416   -0.9903    1.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7976    1.2802   -0.6195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1066    1.5383    1.1686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1571   -0.0407   -1.4242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6633   -1.4605   -0.4877 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0098   -2.8760    0.0299 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7292   -2.2960    0.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1013    1.8989   -0.3611 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4670    0.9259    0.2349 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3404    1.7127    1.4653 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